91702-98-6
91702-98-6 structure
- Name: 3-(Acetylsulfanyl)-2-benzylpropanoic acid
- Chemical Name: 2-[(Acetylthio)methyl]-3-phenylpropionic Acid
- CAS Number: 91702-98-6
- Molecular Formula: C12H14O3S
- Molecular Weight: 238.303
- Create Date: 2018-04-14 08:00:00
- Modify Date: 2024-01-02 11:08:08
| Name | 2-[(Acetylthio)methyl]-3-phenylpropionic Acid |
|---|---|
| Synonyms |
3-(Acetylsulfanyl)-2-benzylpropanoic acid
MFCD00236751 Benzenepropanoic acid, α-[(acetylthio)methyl]- 2-[(Acetylthio)methyl]-phenylpropionic acid 3-{2-[(Acetylsulfanyl)methyl]phenyl}propanoic acid Benzenepropanoic acid, 2-[(acetylthio)methyl]- |
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 387.9±30.0 °C at 760 mmHg |
| Melting Point | 39 °C |
| Molecular Formula | C12H14O3S |
| Molecular Weight | 238.303 |
| Flash Point | 188.4±24.6 °C |
| Exact Mass | 238.066360 |
| PSA | 79.67000 |
| LogP | 2.12 |
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
| Index of Refraction | 1.577 |
| Hazard Codes | Xi |
|---|---|
| HS Code | 2930909090 |
|
~99%
91702-98-6 |
| Literature: Neustadt; Smith; Nechuta; Bronnenkant; Haslanger; Watkins; Foster; Sybertz Journal of Medicinal Chemistry, 1994 , vol. 37, # 15 p. 2461 - 2476 |
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~%
91702-98-6 |
| Literature: US4263293 A1, ; |
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~%
91702-98-6 |
| Literature: Pharmazie, , vol. 61, # 12 p. 994 - 998 |
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~%
91702-98-6 |
| Literature: Pharmazie, , vol. 61, # 12 p. 994 - 998 |
| Precursor 4 | |
|---|---|
| DownStream 1 | |
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |