Articles:
| None found yet. Try the PubMed Search. |
isobergamate
Notes:
None found
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Associate Allied Chemicals Quality, Service and Values Our aim is to become a reliable one-stop shop for our customers. Distributor and Agents of high quality raw materials for the fragrance, flavour and cosmetic industry. Partnering and sourcing raw materials directly from some of the best recognised names to provide consistent quality to our esteemed customers. Email: Info Email: Sachin Gandhi Voice: +91 22 2419 8800 Fax: +91 22 2413 5786 About Product(s): Iso Bergamat
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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): 68683-20-5 4-(isopropyl)cyclohexadiene-1-ethyl formate
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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): 09-54450 2-(4-ISOPROPYLCYCLOHEXADIENYL)ETHYL FORMATE
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| CAS Number: | 68683-20-5 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 272-066-0 | |
| XlogP3-AA: | 2.60 (est) | |
| Molecular Weight: | 194.27386000 | |
| Formula: | C12 H18 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: 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 |
Physical Properties:
Organoleptic Properties:
| Odor Type: floral | |
| Odor Strength: | medium |
| Substantivity: | 8 hour(s) at 100.00 % |
| sweet floral fruity herbal minty | |
| Odor Description: at 100.00 %. | sweet floral fruity herbal minty |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Suppliers:
| Associate Allied Chemicals |
| Iso Bergamat |
| About |
| BOC Sciences |
| For experimental / research use only. |
| 4-(isopropyl)cyclohexadiene-1-ethyl formate |
| Penta International |
| 2-(4-ISOPROPYLCYCLOHEXADIENYL)ETHYL FORMATE |
Safety Information:
| European information : | |
| Most important hazard(s): | |
| Xi - Irritant | |
|
R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36 - Wear suitable protective clothing. | |
| 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: | |
|
oral-rat LD50 3568 mg/kg Food and Chemical Toxicology. Vol. 30, Pg. 75S, 1992. | |
| Dermal Toxicity: | |
|
skin-rabbit LD50 > 5000 mg/kg Food and Chemical Toxicology. Vol. 30, Pg. 75S, 1992. | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | fragrance agents | ||
| RIFM Fragrance Material Safety Assessment: Search | |||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| IFRA Critical Effect: | Dermal sensitization | ||
| IFRA fragrance material specification: | |||
| Should not be used such that the level in finished cosmetic products exceeds 0.1 %. Based on tests showing sensitisation (IFRA guidelines). | |||
| IFRA: | View Standard | ||
| View IFRA Standards Library for complete information. | |||
| Please review Amendment 49 IFRA documentation for complete information. | |||
| IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%): | |||
| Category 1: Products applied to the lips | |||
| 0.077 % | |||
| Category 2: Products applied to the axillae | |||
| 0.023 % | |||
| Category 3: Products applied to the face/body using fingertips | |||
| 0.46 % | |||
| Category 4: Products related to fine fragrance | |||
| 0.43 % | |||
| Category 5: Products applied to the face and body using the hands (palms), primarily leave-on | |||
| Category 5A: Body lotion products applied to the body using the hands (palms), primarily leave-on | |||
| 0.11 % | |||
| Category 5B: Face moisturizer products applied to the face using the hands (palms), primarily leave-on | |||
| 0.11 % | |||
| Category 5C: Hand cream products applied to the hands using the hands (palms), primarily leave-on | |||
| 0.11 % | |||
| Category 5D: Baby Creams, baby Oils and baby talc | |||
| 0.11 % | |||
| Category 6: Products with oral and lip exposure | |||
| 0.25 % | |||
| Category 7: Products applied to the hair with some hand contact | |||
| Category 7A: Rinse-off products applied to the hair with some hand contact | |||
| 0.88 % | |||
| Category 7B: Leave-on products applied to the hair with some hand contact | |||
| 0.88 % | |||
| Category 8: Products with significant anogenital exposure | |||
| 0.045 % | |||
| Category 9: Products with body and hand exposure, primarily rinse off | |||
| 0.84 % | |||
| Category 10: Household care products with mostly hand contact | |||
| Category 10A: Household care excluding aerosol products (excluding aerosol/spray products) | |||
| 3.00 % | |||
| Category 10B: Household aerosol/spray products | |||
| 3.00 % | |||
| Category 11: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate | |||
| Category 11A: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure | |||
| 1.70 % | |||
| Category 11B: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure | |||
| 1.70 % | |||
| Category 12: Products not intended for direct skin contact, minimal or insignificant transfer to skin | |||
| No Restriction | |||
| Notes: | |||
| IFRA FLAVOR REQUIREMENTS: | |||
Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6, materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards. | |||
| Recommendation for menthadienyl formate flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 68683-20-5 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 111516 |
| National Institute of Allergy and Infectious Diseases: | Data |
| SCCNFP: | opinion |
| WGK Germany: | 2 |
| 2-(4-propan-2-yl-1-cyclohexa-1,4-dienyl)ethyl formate | |
| Chemidplus: | 0068683205 |
References:
| 2-(4-propan-2-yl-1-cyclohexa-1,4-dienyl)ethyl formate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 68683-20-5 |
| Pubchem (cid): | 111516 |
| Pubchem (sid): | 135067336 |
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 |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2915.13.0000 |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| agrumen aldehyde | FR | |
| aldehydic | FR | |
| alpine bouquet | FR | |
| amaryllis | FR | |
| apple green apple | FR | |
| ash mountain ash | FR | |
| bayberry | FR | |
| bergamot | FR | |
| blossom tropical blossom | ||
| boronia | FR | |
| boxwood | FR | |
| boxwood blossom | FR | |
| carrot seed | FL/FR | |
| chamomile | FR | |
| chervil | FL | |
| cilantro | FL/FR | |
| citrus | FR | |
| clematis | FR | |
| cologne | FR | |
| cranberry | FR | |
| daffodil | FR | |
| dillenia | FR | |
| evergreen | FR | |
| fern | FR | |
| fig | FR | |
| fir needle oil replacer | FR | |
| floral | FR | |
| foliage | FR | |
| fresh and clean | FR | |
| fruit tropical fruit | FL | |
| geranium | FR | |
| gooseberry | FR | |
| grape | FR | |
| grapefruit | FR | |
| green grass | FR | |
| herbal | FR | |
| hibiscus | FR | |
| ivy | FR | |
| kiwi | FR | |
| lemon | FR | |
| lilac | FR | |
| lime | FR | |
| linden flower | FR | |
| lotus | FR | |
| mimosa | FR | |
| ocean sea | FR | |
| osmanthus | FR | |
| palmarosa oil replacer | FR | |
| pansy | FR | |
| parsley leaf | FL/FR | |
| passion blossom | FR | |
| passion fruit | FR | |
| petitgrain | FR | |
| petitgrain lime petitgrain | FL/FR | |
| pine | FR | |
| pineapple | FR | |
| privet blossom | FR | |
| reseda | FR | |
| rhubarb | FR | |
| rose tea rose | FR | |
| rose wild rose | ||
| saffron | FR | |
| seedy | ||
| spring rain | FR | |
| spruce | FR | |
| tea | FL | |
| tropical | FL | |
| valerian | FL/FR | |
| watercress nasturtium | ||
| wormwood oil replacer | FR | |
| yew | FR |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| iso | bergamate |
| cyclohexadiene-1-ethanol, 4-(1-methylethyl)-, formate | |
| cyclohexadieneethanol, 4-(1-methylethyl)-, formate | |
| formic acid 2-(4-isopropyl cyclohexa-1,4-dien-1-yl) ethyl formate | |
| formic acid 2-(4-isopropylcyclohexa-1,4-dien-1-yl) ethyl formate | |
| formic acid, (menthadien-7-methanyl) ester | |
| menthadiene-7-methyl formate | |
| menthadienyl formate | |
| menthadienyl formiate | |
| 4-(1- | methyl ethyl)-cyclohexadiene-1-ethyl formate |
| 4-(1- | methylethyl)-cyclohexadiene-1-ethyl formate |
| 4-(1- | methylethyl)cyclohexadiene-1-ethanol formate |
| 4-(1- | methylethyl)cyclohexadiene-1-ethyl formate |
| 2-(4- | propan-2-yl-1-cyclohexa-1,4-dienyl)ethyl formate |
| 2-(4-iso | propyl cyclohexadienyl) ethyl formate |
| 4-(iso | propyl)-cyclohexadiene-1-ethyl formate |
| 4-(iso | propyl)cyclohexadiene-1-ethyl formate |
| 2-(4-iso | propylcyclohexadienyl)ethyl formate |