
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 887196-25-0 |
| Catalog No. | 2A-3177230 |
| Chinese Name | (3S,5R)-阿托伐他汀钙盐 |
| Synonyms | (3S,5R)-Atorvastatin Calcium Salt |
| Molecular Formula | C33H35CaFN2O5 |
| Molecular Weight | 1155.34 |
| Purity | 99% |
| Melting Point | 160 ºC |
| Appearance | powder |
| EINECS | 0 |
| HTC | 0 |
| UN(IATA) | 0 |
| PubChem ID | 273004749 |
| 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] |
| InChI | InChI=1S/2C33H35FN2O5.Ca/c2*1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40;/h2*3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);/q;;+2/p-2/t2*26-,27+;/m11./s1 |
| InChI Key | FQCKMBLVYCEXJB-ZDYNVFCDSA-L |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
| MSDS | msds/202656_1_887196_25_0.pdf |
| Transport Info | Product Name: Atorvastatin Calcium Impurity II |
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