Introduction：Basic information about CAS 116287-57-1|4-(2H3)Methyl(2H8)pentan(2H)oic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-(2H3)Methyl(2H8)pentan(2H)oic acid |
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| CAS Number | 116287-57-1 | Molecular Weight | 128.232 |
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| Density | 0.9±0.1 g/cm3 | Boiling Point | 201.0±0.0 °C at 760 mmHg |
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| Molecular Formula | C6D12O2 | Melting Point | / |
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| MSDS | / | Flash Point | 97.2±0.0 °C |
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Names
| Name | 4-methylpentanoic acid-d12 |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.9±0.1 g/cm3 |
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| Boiling Point | 201.0±0.0 °C at 760 mmHg |
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| Molecular Formula | C6D12O2 |
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| Molecular Weight | 128.232 |
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| Flash Point | 97.2±0.0 °C |
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| Exact Mass | 128.159058 |
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| PSA | 37.30000 |
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| LogP | 1.66 |
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| Vapour Pressure | 0.1±0.8 mmHg at 25°C |
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| Index of Refraction | 1.425 |
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| InChIKey | FGKJLKRYENPLQH-BTXGSBRHSA-N |
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| SMILES | CC(C)CCC(=O)O |
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Synonyms
| Pentanoic-2,2,3,3,4,5,5,5-d acid-d, 4-(methyl-d)- |
| 4-(H)Methyl(H)pentan(H)oic acid |
