Introduction：Basic information about CAS 887196-25-0|(3S,5R)-Atorvastatin Calcium Salt, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (3S,5R)-Atorvastatin Calcium Salt |
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| CAS Number | 887196-25-0 | Molecular Weight | 598.71800 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C33H35CaFN2O5 | Melting Point | 160 ºC |
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| MSDS | / | Flash Point | / |
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Names
| Name | 1H-Pyrrole-1-heptanoic acid, 2-(4-fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-, calcium salt (2:1), (βS,δR) |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Melting Point | 160 ºC |
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| Molecular Formula | C33H35CaFN2O5 |
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| Molecular Weight | 598.71800 |
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| Exact Mass | 598.21600 |
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| PSA | 111.79000 |
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| LogP | 6.38660 |
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| InChIKey | FQCKMBLVYCEXJB-ZDYNVFCDSA-L |
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| SMILES | CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CCC(O)CC(O)CC(=O)[O-].CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CCC(O)CC(O)CC(=O)[O-].[Ca+2] |
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Safety Information
| RIDADR | NONH for all modes of transport |
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Synonyms
| (3S,5R)-Atorvastatin Calcium Salt |
| Atorvastatin Related Compound B |
| Atorvastatin Impurity 14 |
| Atorvastatin EP Impurity B |
