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angelic acid, isobutyl ester
Notes:
Flavouring ingredient
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Berje Inc. Where the world comes to its senses Where the world comes to its senses - Berjé is a global distributor of Essential Oils and Aromatic Chemicals. Berjé is a family-owned business that has been in operation for six decades. The company's origins and strength lie in a profound understanding of the supply and the quality of the diverse raw materials consumed by the flavor and fragrance industries. This base was expanded upon more than two decades ago to include fragrance production. The company's unparalleled raw material expertise is focused on the supply of essential oils and aromatic chemicals. This is supported by our long-standing relationships with a worldwide fabric of producers ensuring the greatest prospects for uninterrupted supply in markets that are often volatile and unpredictable. Email: For Information Email: For Sales Voice: 973-748-8980 Fax: 973-680-9618 Instagram Linkedin Flavor Ingredients Fragrance Ingredients Functional Ingredients Media Products List: View Product(s): isoButyl Angelate
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BOC Sciences Best of Chemicals Supplier Quality supplier of research chemicals and biochemicals including inhibitors, building blocks, GMP Products, impurities and metabolites, APIs for Veterinary, Natural Compounds, ADCs, Stem Cell Molecule and chiral compounds. BOC Sciences provides a wide range of services to support the pharmaceutical industry through all stages of drug discovery including Custom Synthesis of those chemicals that are not in stock, Isotope Labeling Service, Chiral Synthesis and Resolution, Bioconjugation, PEGylation services, analytical services. BOC Sciences is a brand of BOCSCI Inc. We leverage our wide spectrum of business in the fields of development, manufacturing, marketing, and distribution to help you make best-informed decisions tailored to your evolving needs for premium chemicals. Our complete suite of CRO services spans the entire molecule development pipeline including contract research for target identification, building blocks, compound synthesis, biochemical and cellular analysis, preclinical animal tests, and clinical studies. Email: Marketing US Email: Marketing Email: Sales US Email: Sales Voice: 1-631-485-4226 Fax: 1-631-614-7828 US Voice: 1-631-485-4226 US Fax: 1-631-614-7828 Europe 44-203-286-1088 Facebook Twitter Linkedin Blog Get the App! Product(s): 7779-81-9 isoButyl Angelate
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Indukern, S.A. F&F Ingredients Division Commitment to quality Idukern F&F Ingredients is your partner for the fragrance and flavor ingredients. Indukern F&F focuses in particular on the service it offers its clients in terms of quality, speed and direct consultancy with more than 1600 different products in stock ready for prompt shipment: Aromachemicals, Essential Oils and Natural Isolates. Email: Info Email: Luciana Soares (Brazil) Email: Gabriela Garcia (Mexico) Email: Jorge Eduardo Clavijo (Colombia) Voice: +34 93 506 91 00 Fax: +34 93 506 91 95 Services Quality Facilities Products List: View Product(s): ISOBUTYL ANGELATE
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Lluch Essence S.L. A family company dedicated to sales and distribution Flexibility, availability, price and quality. Flexibility, availability, price and quality make LLUCH ESSENCE S.L. one of Europe’s references when it comes to essential oils and aroma chemicals, and it is now well known all around the world. Email: Info Voice: 34 93 379 38 49 Fax: 34 93 370 65 04 Linkedin Product(s): ISOBUTYL ANGELATE 95%
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Penta International Corporation Chemistry innovation At Penta, our products and services help businesses do business better. For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes. US Email: Technical Services US Email: Sales US Voice: (973) 740-2300 US Fax: (973) 740-1839 Product(s): 09-37390 ISOBUTYL ANGELATE
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Soda Aromatic Co., Ltd. Depth of Experience We guarantees product safety and quality. Our international sales department is happy to design the most suitable flavor & fragrance for specific uses of processed food, cosmetics, and fragrance manufactures all over the world, specializing in Asia.Let us help you with your flavor & fragrance needs. Email: Info Email: Sales Voice: +81-3-5645-7347 Fax: +81-3-3664-5204 Product(s): 611224001 IsoButyl Angelate
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SRS Aromatics Ltd For over 25 years Bringing flavour and fragrance into your world. As suppliers / distributors of ingredients to the fragrance and flavour industries, our goal is to provide high quality materials at competitive prices with an exceptional level of service. Established in 1984, SRS Aromatics Ltd is an independent family owned business which has become very well-respected within the fragrance and flavour industry as a reliable and trustworthy partner. Over the years this has allowed the company to develop strong relationships with many global manufacturers; several of whom we represent in the UK. A core aim of our business is to work extremely closely with both our suppliers and customers to maximise service levels with minimum disruption to supply. Email: Info Email: Sales Voice: +44 (0) 1284 704076 Fax: +44 (0) 1284 760819 Twitter Linkedin News Product(s): ISO BUTYL ANGELATE 70 ISO BUTYL ANGELATE 95
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Synerzine, Inc. Innovation. Customization. Aroma Ingredients. Synerzine is a leading supplier of flavor and fragrance ingredients. Synerzine expresses what we have grown to embody as an organization - the synergy and connection between raw ingredients, science, technology, and the final product. Our experienced team is passionate about bringing our customers high-quality innovative ingredients that they can trust. Building upon our 44 year history, the Synerzine team provides customers around the globe with convenient access to over 1200 high-quality aroma ingredients. We actively engage with customers to add a wide array of new products and services on a regular basis. Our aim is to delight every customer with our exceptional services, large product selection, customization and the highest quality and safety standards. We provide our customers with true value designed to help them bring their products to market faster. US Email: Customer Service US Email: Sales US Voice: (404) 524-6744 US Fax: (404) 577-1651 Inquiry Products List: View Product(s): W0930 isoButyl Angelate W0930-B *ISOBUTYL ANGELATE ("B" GRADE)
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TCI AMERICA Moving Your Chemistry Forward We continuously strive to advance our technology. With East & West Coast distribution centers, count on TCI to deliver products quickly and reliably. Over 30,000 Reagents available today in benchtop to bulk quantities. We also offer custom synthesis solutions. Sign up for a TCI account today for fast and free shipping! Tokyo Chemical Industry Co., Ltd. (TCI) is a leading worldwide manufacturer of specialty organic chemicals founded in 1946. TCI provides organic laboratory chemicals as well as pharmaceutical, cosmetic and functional materials. More than 70 years of synthesis experience and multi-purpose plants enable TCI to offer more than 30,000 products as well as custom synthesis. US Email: Sales Email: Technical Support Voice: 1-800-423-8616 Fax: 1- 888-520-1075 Facebook Twitter Instagram Linkedin Product(s): A1127 isobutyl angelate >98.0%(GC)
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| CAS Number: | 7779-81-9 |  3D/inchi
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| ECHA EINECS - REACH Pre-Reg: | 231-941-7 | |
| FDA UNII: | 7OR98SJS39 | |
| Nikkaji Web: | J68.564J | |
| MDL: | MFCD00063646 | |
| CoE Number: | 247 | |
| XlogP3: | 2.90 (est) | |
| Molecular Weight: | 156.22492000 | |
| Formula: | C9 H16 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: flavor and fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
| JECFA Food Flavoring: | 1213 isobutyl angelate |
| DG SANTE Food Flavourings: | 09.408 2-butyl 2-methylbut-2(cis)-enoate |
| FEMA Number: | 2180 isobutyl angelate |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 7779-81-9 ; ISOBUTYL ANGELATE |
| FDA Regulation: | |
| FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION Subpart F--Flavoring Agents and Related Substances Sec. 172.515 Synthetic flavoring substances and adjuvants. | |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 98.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.87400 to 0.88000 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 7.273 to 7.322 |
| Refractive Index: | 1.43800 to 1.44600 @ 20.00 °C. |
| Boiling Point: | 176.00 to 177.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.617000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 140.00 °F. TCC ( 60.00 °C. ) |
| logP (o/w): | 3.279 (est) |
| Soluble in: | |
| alcohol | |
| water, very slightly | |
| water, 164.4 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: spicy | |
| herbal green spicy cooling woody caraway celery sweet | |
| Odor Description: at 100.00 %. | herbal green spicy cooling woody caraway celery sweet |
| spicy green weedy | |
| Odor Description: | Spicy, green and weedy Mosciano, Gerard P&F 16, No. 1, 31, (1991) |
| Flavor Type: green | |
| green sweet spicy | |
| Taste Description: at 10.00 ppm. | Green, sweet and spicy Mosciano, Gerard P&F 16, No. 1, 31, (1991) |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Suppliers:
| Berjé |
| isoButyl Angelate |
| Media |
| BOC Sciences |
| For experimental / research use only. |
| isoButyl Angelate |
| Indukern F&F |
| ISOBUTYL ANGELATE
Odor: FRUITY, HERBAL, SPICY, WARM |
| Lluch Essence |
| ISOBUTYL ANGELATE 95% |
| Miltitz Aromatics |
| isoBUTYL ANGELATE 70
min. 70 % Odor: Fresh-herbaceous, green, spicy, fruity, reminiscent of camomile Use: ISOBUTYL ANGELATE 70, being an essential component in the natural Roman camomile oil, figures as a key substance for the artificial creation of this oil. Furthermore, this ester is mainly used in herbal compositions for cosmetic purposes. |
| Miltitz Aromatics |
| isoBUTYL ANGELATE 95 |
| Penta International |
| ISOBUTYL ANGELATE |
| Quimdis |
| Isobutyl Angelate 70 |
| Soda Aromatic |
| IsoButyl Angelate |
| SRS Aromatics |
| ISO BUTYL ANGELATE 70 |
| SRS Aromatics |
| ISO BUTYL ANGELATE 95 |
| Synerzine |
| *ISOBUTYL ANGELATE ("B" GRADE) |
| Synerzine |
| isoButyl Angelate |
| TCI AMERICA |
| For experimental / research use only. |
| isobutyl angelate >98.0%(GC) |
Safety Information:
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | flavor and fragrance agents | ||
| RIFM Fragrance Material Safety Assessment: Search | |||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for isobutyl angelate usage levels up to: | |||
| 1.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.12 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 0.10 (μg/capita/day) | ||
| Threshold of Concern: | 1800 (μg/person/day) | ||
| Structure Class: | I | ||
| Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). | |||
| The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library | |||
| publication number: 3 | |||
| Click here to view publication 3 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | - | |
| beverages(nonalcoholic): | - | 1.50000 | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | - | |
| condiments / relishes: | - | - | |
| confectionery froastings: | 3.00000 | 100.00000 | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 1.50000 | |
| fruit ices: | - | 1.50000 | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | 5.00000 | |
| imitation dairy: | - | - | |
| instant coffee / tea: | - | - | |
| jams / jellies: | - | - | |
| meat products: | - | - | |
| milk products: | - | - | |
| nut products: | - | - | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | - | - | |
| snack foods: | - | - | |
| soft candy: | - | - | |
| soups: | - | - | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
Safety References:
| European Food Safety Athority(EFSA): | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| European Food Safety Authority (EFSA) reference(s): | |
| Flavouring Group Evaluation 72 (FGE.72): Consideration of aliphatic, branched-chain saturated and unsaturated alcohols, aldehydes, acids, and related esters evaluated by the JECFA (61st meeting) structurally related to branched- and straight-chain unsaturated carboxylic acids. Esters of these and straight-chain aliphatic saturated alcohols evaluated by EFSA in FGE.05Rev2 (2010) View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 72, Revision 1 (FGE.72Rev1): Consideration of aliphatic, branched-chain saturated and unsaturated alcohols, aldehydes, acids, and related esters evaluated by the JECFA (61st meeting) structurally related to branched- and straight-chain unsaturated carboxylic acids, esters of these and straight-chain aliphatic saturated alcohols evaluated by EFSA in FGE.05Rev2 View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 72, Revision 2 (FGE.72Rev2): consideration of aliphatic, branched-chain saturated and unsaturated alcohols, aldehydes, acids and related esters evaluated by JECFA (61st, 68th and 69th meetings) and structurally related to flavouring substances in FGE.05Rev3 View page or View pdf | |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 7779-81-9 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 5367807 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WISER: | UN 3272 |
| WGK Germany: | 3 |
| 2-methylpropyl (Z)-2-methylbut-2-enoate | |
| Chemidplus: | 0007779819 |
References:
| 2-methylpropyl (Z)-2-methylbut-2-enoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 7779-81-9 |
| Pubchem (cid): | 5367807 |
| Pubchem (sid): | 135263077 |
| Pherobase: | View |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| FDA Substances Added to Food (formerly EAFUS): | View |
| HMDB (The Human Metabolome Database): | HMDB37629 |
| FooDB: | FDB016743 |
| Export Tariff Code: | 2916.19 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| caraway seed | FL/FR | |
| chamomile | FR | |
| dill weed | FL/FR | |
| pepper | FR | |
| spearmint | FR | |
| spice | FR | |
| tobacco | FR |
Occurrence (nature, food, other): note
| chamomile garden chamomile plant Search Trop Picture | |
| chamomile oil @ 4.03% Data GC Search PMC Picture | |
| chamomile roman chamomile oil Search Trop Picture |
Synonyms:
| angelic acid isobutyl ester | |
| angelic acid, isobutyl ester | |
| 2- | butenoic acid, 2-methyl-, 2-methylpropyl ester, (2Z)- |
| 2- | butenoic acid, 2-methyl-, 2-methylpropyl ester, (Z)- |
| iso | butyl (2Z)-2-methyl-2-butenoate |
| iso | butyl (2Z)-2-methylbut-2-enoate |
| iso | butyl (Z)-2-methyl-2-butenoate |
| (Z)-iso | butyl 2-methyl crotonoate |
| iso | butyl 2-methyl isocrotonate |
| 2- | butyl 2-methylbut-2(cis)-enoate |
| iso | butyl 2-methylcrotonoate, (Z)- |
| iso | butyl angelate 70 |
| iso | butyl angelate 95 |
| iso | butyl cis-2-methyl-2-butenoate |
| crotonic acid, 2-methyl-, isobutyl ester, (Z)- | |
| 2- | methyl propyl (Z)-2-methyl-2-butenoate |
| methyl propyl 2-methyl isocrotonate | |
| (Z)-2- | methyl propyl 2-methyl-2-butenoate |
| (Z)-2- | methyl-2-butenoic acid 2-methyl propyl ester |
| 2- | methylpropyl (Z)-2-methylbut-2-enoate |
| 2- | methylpropyl 2-methyl-2-butenoate, (Z)- |
| 2- | methylpropyl angelate |