Articles:
4-hexen-1-ol, 5-methyl-2-(1-methylethenyl)-, acetate
Notes:
None found
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Chemical sources Association Inc Exchange of knowledge Need This Item for Flavor? You can contact the Chemical Sources Association. Events Links Product(s):
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| CAS Number: | 25905-14-0 |  3D/inchi
|
| Other(deleted CASRN): | 50373-59-6 | |
| ECHA EINECS - REACH Pre-Reg: | 247-327-7 | |
| FDA UNII: | OU6ZF37MOM | |
| Nikkaji Web: | J36.845H | |
| Beilstein Number: | 1725269 | |
| MDL: | MFCD00216731 | |
| XlogP3-AA: | 3.60 (est) | |
| Molecular Weight: | 196.28980000 | |
| Formula: | C12 H20 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
| EFSA/JECFA Comments: | Racemate (EFFA, 2010a). | |
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 |
| DG SANTE Food Flavourings: | 09.612 lavandulyl acetate |
Physical Properties:
| Appearance: | colorless clear oily liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.90900 to 0.91500 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 7.564 to 7.614 |
| Refractive Index: | 1.45300 to 1.45900 @ 20.00 °C. |
| Boiling Point: | 228.00 to 229.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.072000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 159.00 °F. TCC ( 70.56 °C. ) |
| logP (o/w): | 3.518 (est) |
| Soluble in: | |
| alcohol | |
| water, 6.816 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| Acetic acid lavandulyl ester 95% |
| Diffusions Aromatiques |
| ACETATE LAVANDULYLE |
| ExtraSynthese |
| For experimental / research use only. |
| (+/-)-Lavandulyl Acetate (GC) ≥95% |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| Lavandulyl Acetate ≥96% |
| Sigma-Aldrich |
| For experimental / research use only. |
| (±)-Lavandulyl Acetate analytical standard |
| Chemical Sources Association |
| Need This Item for Flavor/Food?: You can contact the CSA |
Safety Information:
| Preferred SDS: View | |
| 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 lavandulyl acetate usage levels up to: | |||
| 10.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.012 (μg/capita/day) | ||
| Modified Theoretical Added Maximum Daily Intake (mTAMDI): | 3900 (μg/person/day) | ||
| Threshold of Concern: | 1800 (μg/person/day) | ||
| Structure Class: | I | ||
| Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i). | |||
| Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm. | |||
| average usage mg/kg | maximum usage mg/kg | ||
| Dairy products, excluding products of category 02.0 (01.0): | 7.00000 | 35.00000 | |
| Fats and oils, and fat emulsions (type water-in-oil) (02.0): | 2.00000 | 10.00000 | |
| Edible ices, including sherbet and sorbet (03.0): | 10.00000 | 50.00000 | |
| Processed fruit (04.1): | 7.00000 | 35.00000 | |
| Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): | - | - | |
| Confectionery (05.0): | 10.00000 | 50.00000 | |
| Chewing gum (05.0): | - | - | |
| Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): | 5.00000 | 25.00000 | |
| Bakery wares (07.0): | 10.00000 | 50.00000 | |
| Meat and meat products, including poultry and game (08.0): | 2.00000 | 10.00000 | |
| Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): | 2.00000 | 10.00000 | |
| Eggs and egg products (10.0): | - | - | |
| Sweeteners, including honey (11.0): | - | - | |
| Salts, spices, soups, sauces, salads, protein products, etc. (12.0): | 5.00000 | 25.00000 | |
| Foodstuffs intended for particular nutritional uses (13.0): | 10.00000 | 50.00000 | |
| Non-alcoholic ("soft") beverages, excl. dairy products (14.1): | 5.00000 | 25.00000 | |
| Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): | 10.00000 | 50.00000 | |
| Ready-to-eat savouries (15.0): | 20.00000 | 100.00000 | |
| Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): | 5.00000 | 25.00000 | |
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): | |
| Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 6 (FGE.06): Straight-and branched-chain aliphatic unsatured primary alcohols, aldehydes, carboxylic acids, and esters from chemical groups 1 and 4 View page or View pdf | |
| Flavouring Group Evaluation 6, Revision 1 (FGE.06Rev1) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) View page or View pdf | |
| Flavouring Group Evaluation 62 (FGE.62) Consideration of linear and branched-chain aliphatic unsaturated, unconjugated alcohols, aldehydes, acids, and related esters evaluated by JECFA (61st meeting) structurally related to esters of branched- and straight-chain aliphatic saturated primary alcohols and of one secondary alcohol, and branched- and straight-chain unsaturated carboxylic acids evaluated by EFSA in FGE.05 (2005) and to straight- and branched-chain aliphatic unsaturated primary alcohols, aldehydes, carboxylic acids, and esters evaluated by EFSA in FGE.06 (2004) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 06, Revision 2 (FGE.06Rev2): Straight- and branched-chain aliphatic unsaturated primary alcohols, aldehydes, carboxylic acids, and esters from chemical groups 1 and 4 View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 06, Revision 3 (FGE.06Rev3): Straight- and branched-chain aliphatic unsaturated primary alcohols, aldehydes, carboxylic acids, and esters from chemical groups 1 and 4 View page or View pdf | |
| Scientific Opinion on Flavouring Group Evaluation 06, Revision 4 (FGE.06Rev4): Straight- and branched-chain aliphatic unsaturated primary alcohols, aldehydes, carboxylic acids and esters from chemical groups 1, 3 and 4 View page or View pdf | |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 25905-14-0 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 30247 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| (5-methyl-2-prop-1-en-2-ylhex-4-enyl) acetate | |
| Chemidplus: | 0025905140 |
References:
| (5-methyl-2-prop-1-en-2-ylhex-4-enyl) acetate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 25905-14-0 |
| Pubchem (cid): | 30247 |
| Pubchem (sid): | 134994553 |
| 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 |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2915.39.9050 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| artemisia santolina schrenk oil iran @ 9.50% Data GC Search Trop Picture | |
| basil oil CO2 sweet @ 0.78% Data GC Search Trop Picture | |
| basil oil sweet @ 0.55% Data GC Search Trop Picture | |
| bergamot mint oil @ 0.0-1.4% Data GC Search Trop Picture | |
| lavandin absolute grosso @ 1.80% Data GC Search Trop Picture | |
| lavandin oil abrialis @ 2.64% Data GC Search Trop Picture | |
| lavandin oil grosso @ 2.27% Data GC Search Trop Picture | |
| lavandula officinalis flower oil @ 2.00% Data GC Search Trop Picture | |
| lavender flower oil lithuania @ 5.49% Data GC Search Trop Picture | |
| lavender oil france @ 5.46% Data GC Search Trop Picture | |
| lavender oil greece @ 16.01% Data GC Search Trop Picture | |
| lavender oil spike @ 0.30% Data GC Search Trop Picture | |
| lavender stem oil lithuania @ 4.10% Data GC Search Trop Picture | |
| lemongrass oil rwanda @ 0.60% Data GC Search Trop Picture | |
| otanthus maritimus (l.) hoffmans oil greece @ 0.50% Data GC Search Trop Picture | |
| rosemary oil france @ trace-0.54% Data GC Search Trop Picture | |
| rosemary oil morocco @ 0.00-0.30% Data GC Search Trop Picture | |
| wormseed oil spain @ 0.02% Data GC Search Trop Picture | |
| wormwood oil america @ 1.81% Data GC Search Trop Picture | |
| yarrow oil hungary @ 4.40% Data GC Search Trop Picture |
Synonyms:
| 3- | acetoxymethyl-2,6-dimethyl-1,5-heptadiene |
| 4- | hexen-1-ol, 2-isopropenyl-5-methyl-, acetate |
| 4- | hexen-1-ol, 5-methyl-2-(1-methylethenyl)-, acetate |
| lavandulol acetate | |
| (±)- | lavandulol acetate |
| (±)- | lavandulyl acetate |
| 5- | methyl-2-(1-methyl ethenyl)-4-hexen-1-ol acetate |
| 5- | methyl-2-(1-methylethenyl)-4-hexen-1-ol acetate |
| 5- | methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl acetate |
| (5- | methyl-2-prop-1-en-2-ylhex-4-enyl) acetate |
| 2-iso | propenyl-5-methyl hex-4-enyl acetate |
| 2-iso | propenyl-5-methyl-4-hexen-1-yl acetate |
| 2-iso | propenyl-5-methyl-4-hexenyl acetate |
| 2-iso | propenyl-5-methylhex-4-enyl acetate |