undecyl acetate
undecanyl acetate
Identification
| Name | undecyl acetate |
| IUPAC | undecyl acetate |
| CAS Number | 1731-81-3 |
| EINECS | 217-051-1 |
| FDA UNII | 70Z4PZ8M0S |
| Molecular Formula | C13 H26 O2 |
| Molecular Weight | 214.34862000 |
| MDL Number | MFCD00056189 |
| Nikkaji Number | J118.402D |
| CoE Number | 10906 |
| XlogP3 | 5.00 (est) |
Regulatory
| DG SANTE Food Flavourings | 09.820 undecyl acetate |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 97.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.85800 to 0.86400 @ 25.00 °C. |
| Pounds per Gallon - (est). | 7.139 to 7.189 |
| Boiling Point | 259.00 to 260.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.013000 mmHg @ 25.00 °C. (est) |
| Flash Point | 231.00 °F. TCC ( 110.56 °C. ) |
| logP (o/w) | 5.371 (est) |
| Soluble in | alcohol |
Organoleptic Properties
| Odor Description | at 100.00 %. |
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | Not determined |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | flavor and fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| Recommendation for undecyl acetate usage levels up to | 6.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 0.0012 (μg/capita/day) |
| Modified Theoretical Added Maximum Daily Intake (mTAMDI) | 3900 (μg/person/day) |
| Threshold of Concern | 1800 (μg/person/day) |
| Structure Class | I |
| Dairy products, excluding products of category 02.0 (01.0) | 7.00000 |
| Fats and oils, and fat emulsions (type water-in-oil) (02.0) | 5.00000 |
| Edible ices, including sherbet and sorbet (03.0) | 10.00000 |
| Processed fruit (04.1) | 7.00000 |
| Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2) | - |
| Confectionery (05.0) | 10.00000 |
| Chewing gum (05.3) | - |
| Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0) | 5.00000 |
| Bakery wares (07.0) | 10.00000 |
| Meat and meat products, including poultry and game (08.0) | 2.00000 |
| Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0) | 2.00000 |
| Eggs and egg products (10.0) | - |
| Sweeteners, including honey (11.0) | - |
| Salts, spices, soups, sauces, salads, protein products, etc. (12.0) | 5.00000 |
| Foodstuffs intended for particular nutritional uses (13.0) | 10.00000 |
| Non-alcoholic ("soft") beverages, excl. dairy products (14.1) | 5.00000 |
| Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2) | 10.00000 |
| Ready-to-eat savouries (15.0) | 20.00000 |
| Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0) | 5.00000 |
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Exchange of knowledge
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Potential Uses
Natural Occurrence
Synonyms
1-
undecanol acetate
1-
undecanol, acetate
undecanyl acetate
N-
undecyl acetate
PubMed:
Concentration-detection functions for eye irritation evoked by homologous n-alcohols and acetates approaching a cut-off point.
PubMed:
Determination of volatile compounds in grape distillates by solid-phase extraction and gas chromatography.
PubMed:
Molecular restrictions for human eye irritation by chemical vapors.
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Prostate-specific antigen immunosensing based on mixed self-assembled monolayers, camel antibodies and colloidal gold enhanced sandwich assays.
PubMed:
Compounds modifying the activity of two sex attractants for males of the pea moth,Cydia nigricana (F.).
PubMed:
A novel ketone monooxygenase from Pseudomonas cepacia. Purification and properties.
PubMed:
Source of oxygen in the conversion of 2-tridecanone to undecyl acetate by Pseudomonas cepacia and Nocardia sp.
PubMed:
Purification and properties of undecyl acetate esterase from Pseudomonas cepacia grown on 2-tridecanone.
PubMed:
Specificity and induction of undecyl acetate esterase from Pseudomonas cepacia grown on 2-tridecanone.
PubMed:
Oxidative degradation of methyl ketones. II. Chemical pathway for degradation of 2-tridecanone by Pseudomonas multivorans and Pseudomonas aeruginosa.