methyl 3-(phenyl thio) isobutyrate
propanoic acid, 2-methyl-3-(phenylthio)-, methyl ester
Identification
| Name | methyl 3-(phenyl thio) isobutyrate |
| IUPAC | methyl 2-methyl-3-phenylsulfanylpropanoate |
| CAS Number | 777-80-0 |
| EINECS | 212-290-8 |
| FDA UNII | Search |
| Molecular Formula | C11 H14 O2 S |
| Molecular Weight | 210.29598000 |
| MDL Number | MFCD00025873 |
| Nikkaji Number | J193.167I |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 301.10 °C. @ 760.00 mm Hg (est) |
| Flash Point | 276.00 °F. TCC ( 135.70 °C. ) (est) |
| logP (o/w) | 2.610 (est) |
| Soluble in | water, 97.52 mg/L @ 25 °C (est) |
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 | information only not used for fragrances or flavors |
| Recommendation for methyl 3-(phenyl thio) isobutyrate usage levels up to | not for fragrance use. |
| Recommendation for methyl 3-(phenyl thio) isobutyrate flavor usage levels up to | not for flavor use. |
No supplier data available
Potential Uses
Natural Occurrence
Synonyms
methyl 2-methyl-3-(phenylthio)propionate
methyl 2-methyl-3-phenylsulfanylpropanoate
methyl 3-(phenylthio)isobutyrate
2-
methyl-3-(phenylthio)propionic acid, methyl ester
propanoic acid, 2-methyl-3-(phenylthio)-, methyl ester
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