methyl 3-oxohexanoate
hexanoic acid, 3-oxo-, methyl ester
Identification
| Name | methyl 3-oxohexanoate |
| CAS Number | 30414-54-1 |
| EINECS | 250-185-9 |
| FDA UNII | Search |
| Molecular Formula | C7 H12 O3 |
| Molecular Weight | 144.17024000 |
| MDL Number | MFCD00040995 |
| Nikkaji Number | J101.363G |
Regulatory
Physical Properties
| Appearance | colorless to pale yellow clear liquid (est) |
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Melting Point | -43.00 °C. @ 760.00 mm Hg |
| Boiling Point | 193.00 to 194.00 °C. @ 760.00 mm Hg (est), 85.00 to 90.00 °C. @ 5.00 mm Hg |
| Vapor Pressure | 0.475000 mmHg @ 25.00 °C. (est) |
| Flash Point | 164.00 °F. TCC ( 73.20 °C. ) (est) |
| logP (o/w) | 0.877 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
No sensory data available
Safety Information
| Preferred SDS | View |
| 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 | natural substances and extractives |
| Recommendation for methyl 3-oxohexanoate usage levels up to | not for fragrance use. |
| Recommendation for methyl 3-oxohexanoate flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
butyrylacetic acid methyl ester
3-keto
hexanoic acid methyl ester
3-oxo
hexanoic acid methyl ester
hexanoic acid, 3-oxo-, methyl ester
methyl 3-ketocaproate
methyl 3-oxocaproate
methyl butyryl acetate
methyl butyrylacetate
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