Introduction：Basic information about CAS 210980-68-0|Dehydrosimvastatin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Dehydrosimvastatin |
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| CAS Number | 210980-68-0 | Molecular Weight | 400.551 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 536.8±50.0 °C at 760 mmHg |
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| Molecular Formula | C25H36O4 | Melting Point | / |
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| MSDS | / | Flash Point | 265.6±28.5 °C |
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Names
| Name | [(1S,3R,7S,8S,8aR)-3,7-dimethyl-8-[2-[(2R)-6-oxo-2,3-dihydropyran-2-yl]ethyl]-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate |
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| Synonym | More Synonyms |
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Dehydrosimvastatin BiologicalActivity
| Description | Anhydrosimvastatin (Impurity C) is an impurity of Simvastatin. Simvastatin is a competitive inhibitor of HMG-CoA reductase[1]. |
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| Related Catalog | Research Areas >>OthersSignaling Pathways >>Others >>Others |
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| References | [1]. IOANA DRĂGHICI, et al. DEVELOPMENT OF A NEW LC METHOD FOR THE IDENTIFICATION, SEPARATION AND ASSAY OF SIMVASTATIN AND ITS IMPURITIES. FARMACIA, 2013, Vol. 61, 2. |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 536.8±50.0 °C at 760 mmHg |
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| Molecular Formula | C25H36O4 |
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| Molecular Weight | 400.551 |
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| Flash Point | 265.6±28.5 °C |
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| Exact Mass | 400.261353 |
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| PSA | 52.60000 |
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| LogP | 5.81 |
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| Vapour Pressure | 0.0±1.4 mmHg at 25°C |
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| Index of Refraction | 1.529 |
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| InChIKey | BIYWBTKPNWCYHM-RLSQPJRHSA-N |
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| SMILES | CCC(C)(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC=CC(=O)O3)C21 |
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Safety Information
| Hazard Codes | Xi |
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| RIDADR | NONH for all modes of transport |
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Synonyms
| Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-8-[2-[(2R)-3,6-dihydro-6-oxo-2H-pyran-2-yl]ethyl]-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-1-naphthalenyl ester |
| anhydrosimvastatin |
| (1S,3R,7S,8S,8aR)-3,7-Dimethyl-8-{2-[(2R)-6-oxo-3,6-dihydro-2H-pyran-2-yl]ethyl}-1,2,3,7,8,8a-hexahydro-1-naphthalenyl 2,2-dimethylbutanoate |
| Dehydrosimvastatin |
| Dehydro Simvastatin |
| Anhydro-simvastatin |
| Simvastatin EP Impurity C |
| Dehydrosimvastatin |
| Simvastatin Impurity 3 |
