Introduction：Basic information about CAS 517-33-9|7,12-diketolithocholic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 7,12-diketolithocholic acid |
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| CAS Number | 517-33-9 | Molecular Weight | 404.540 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 582.2±50.0 °C at 760 mmHg |
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| Molecular Formula | C24H36O5 | Melting Point | / |
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| MSDS | / | Flash Point | 320.0±26.6 °C |
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Names
| Name | 7,12-dioxolitocholic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 582.2±50.0 °C at 760 mmHg |
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| Molecular Formula | C24H36O5 |
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| Molecular Weight | 404.540 |
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| Flash Point | 320.0±26.6 °C |
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| Exact Mass | 404.256287 |
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| PSA | 91.67000 |
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| LogP | 2.22 |
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| Vapour Pressure | 0.0±3.7 mmHg at 25°C |
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| Index of Refraction | 1.543 |
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| InChIKey | MAFJMPFLJJCSTB-FQBQTYDJSA-N |
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| SMILES | CC(CCC(=O)O)C1CCC2C3C(=O)CC4CC(O)CCC4(C)C3CC(=O)C12C |
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| Storage condition | 2-8°C |
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Synonyms
| 3α-hydroxy-7,12-dioxo-5β-cholanoic-24 acid |
| Cholan-24-oic acid, 3-hydroxy-7,12-dioxo-, (3α,5β)- |
| 3α-hydroxy-7,12-dioxo-5β-cholane-24-oic acid |
| 7,12-dioxo-lithocholic acid |
| 3α-hydroxy-7,12-diketo-5β-cholan-24-oic acid |
| 3α-hydroxy-7,12-dioxo-5β-cholan-24-oic acid |
| (R)-4-((3R,5S,8R,9S,10S,13R,14S,17R)-3-Hydroxy-10,13-dimethyl-7,12-dioxo-hexadecahydro-cyclopenta[a]phenanthren-17-yl)-pentanoic acid |
| (3α,5β)-3-Hydroxy-7,12-dioxocholan-24-oic acid |
| 7,12-diketolithocholic acid |
