Introduction：Basic information about CAS 219929-89-2|4-[(4-METHYLPHENYL)THIO]-3-NITROBENZOIC ACID, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-[(4-METHYLPHENYL)THIO]-3-NITROBENZOIC ACID |
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| CAS Number | 219929-89-2 | Molecular Weight | 289.30600 |
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| Density | 1.42g/cm3 | Boiling Point | 464.8ºC at 760mmHg |
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| Molecular Formula | C14H11NO4S | Melting Point | / |
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| MSDS | / | Flash Point | 234.9ºC |
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Names
| Name | 4-(4-methylphenyl)sulfanyl-3-nitrobenzoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.42g/cm3 |
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| Boiling Point | 464.8ºC at 760mmHg |
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| Molecular Formula | C14H11NO4S |
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| Molecular Weight | 289.30600 |
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| Flash Point | 234.9ºC |
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| Exact Mass | 289.04100 |
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| PSA | 108.42000 |
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| LogP | 4.27580 |
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| Vapour Pressure | 1.95E-09mmHg at 25°C |
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| Index of Refraction | 1.678 |
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| InChIKey | XXUBZSQLPIRCFW-UHFFFAOYSA-N |
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| SMILES | Cc1ccc(Sc2ccc(C(=O)O)cc2[N+](=O)[O-])cc1 |
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Synonyms
| HMS545L16 |
| 4-[(4-Methylphenyl)thio]-3-nitrobenzoic acid |
