Introduction：Basic information about CAS 100961-52-2|2-(4-CYANO-BENZYLSULFANYL)-BENZOIC ACID, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-(4-CYANO-BENZYLSULFANYL)-BENZOIC ACID |
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| CAS Number | 100961-52-2 | Molecular Weight | 269.31800 |
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| Density | / | Boiling Point | 478.6ºC at 760mmHg |
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| Molecular Formula | C15H11NO2S | Melting Point | / |
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| MSDS | / | Flash Point | 243.2ºC |
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Names
| Name | 2-[(4-cyanophenyl)methylsulfanyl]benzoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Boiling Point | 478.6ºC at 760mmHg |
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| Molecular Formula | C15H11NO2S |
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| Molecular Weight | 269.31800 |
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| Flash Point | 243.2ºC |
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| Exact Mass | 269.05100 |
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| PSA | 86.39000 |
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| LogP | 3.54878 |
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| Vapour Pressure | 5.73E-10mmHg at 25°C |
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| Index of Refraction | 1.668 |
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| InChIKey | NCFIAZPXLCPUKJ-UHFFFAOYSA-N |
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| SMILES | N#Cc1ccc(CSc2ccccc2C(=O)O)cc1 |
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Safety Information
Customs
| HS Code | 2930909090 |
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| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| 2-(4-Cyano-benzylsulfanyl)-benzoic acid |
| 2-(2-HYDROXYCARBONYL-6-PYRIDYL)MALONDIALDEHYDE |
| 2-(4-Cyan-benzylmercapto)-benzoesaeure |
| Benzoic acid,2-[[(4-cyanophenyl)methyl]thio] |
