Introduction：Basic information about CAS 845790-49-0|5-OXO-5-(4-THIOMETHYLPHENYL)VALERIC ACID, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 5-OXO-5-(4-THIOMETHYLPHENYL)VALERIC ACID |
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| CAS Number | 845790-49-0 | Molecular Weight | 238.30300 |
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| Density | 1.22g/cm3 | Boiling Point | 456.6ºC at 760 mmHg |
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| Molecular Formula | C12H14O3S | Melting Point | / |
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| MSDS | / | Flash Point | 229.9ºC |
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Names
| Name | 5-(4-methylsulfanylphenyl)-5-oxopentanoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.22g/cm3 |
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| Boiling Point | 456.6ºC at 760 mmHg |
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| Molecular Formula | C12H14O3S |
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| Molecular Weight | 238.30300 |
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| Flash Point | 229.9ºC |
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| Exact Mass | 238.06600 |
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| PSA | 79.67000 |
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| LogP | 2.84610 |
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| Index of Refraction | 1.577 |
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| InChIKey | YXVDDYAHAFDVIY-UHFFFAOYSA-N |
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| SMILES | CSc1ccc(C(=O)CCCC(=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
| 5-(4-Methylmercapto-phenyl)-5-oxo-valeriansaeure |
| 5-(4-methylsulfanyl-phenyl)-5-oxo-valeric acid |
| 5-Oxo-5-(4-thiomethylphenyl)valeric acid |
