allyl isononylate
allyl trimethylhexoate
Identification
| Name | allyl isononylate |
| IUPAC | prop-2-enyl 5,5-dimethylheptanoate |
| CAS Number | 68132-80-9 |
| EINECS | 268-648-9 |
| FDA UNII | Search |
| Molecular Formula | C12 H22 O2 |
| Molecular Weight | 198.30574000 |
Regulatory
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.86900 to 0.87600 @ 20.00 °C. |
| Pounds per Gallon - (est). | 7.239 to 7.298 |
| Refractive Index | 1.42900 to 1.43300 @ 20.00 °C. |
| Boiling Point | 208.00 to 210.00 °C. @ 760.00 mm Hg |
| Acid Value | 1.00 max. KOH/g |
| Vapor Pressure | 0.032000 mmHg @ 25.00 °C. (est) |
| Flash Point | 181.00 °F. TCC ( 82.78 °C. ) |
| logP (o/w) | 4.402 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
| Similar Items | note |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Description | at 100.00 %. |
Safety Information
| 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 | fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| IFRA Purity Specification | < 0.1% free allyl alcohol |
| Recommendation for allyl isononylate usage levels up to | 5.0000 % in the fragrance concentrate. |
| Recommendation for allyl isononylate flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
allyl isononylate
allyl trimethyl hexanoate
5,5-
allyl trimethyl hexanoate
allyl trimethylhexoate
hexanoic acid, methyl-, 2-propen-1-yl ester
hexanoic acid, trimethyl-, 2-propenyl ester
prop-2-en-1-yl 5,5-dimethylheptanoate
prop-2-enyl 5,5-dimethyl heptanoate
prop-2-enyl 5,5-dimethylheptanoate
2-
propenyl 5,5-dimethyl heptanoate
2-
propenyl trimethyl hexanoate
trimethyl hexanoic acid 2-propenyl ester
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