
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1378391-43-5 |
| Catalog No. | 2A-1182044 |
| Chinese Name | 维帕他韦中间体 N-3 |
| Synonyms | Exact Mass 833.373474; PSA 193.38000; LogP 5.19; Index of Refraction 1.608; InChIKey VIUSEVDFPVOBFC-UHFFFAOYSA-N; Synonyms |
| Molecular Formula | C44H55N3O13 |
| Molecular Weight | 833.920 |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 963.0±65.0 °C at 760 mmHg |
| PubChem ID | 240305577 |
| SMILES | COCC1CC(C(=O)OCC(=O)c2ccc3c(c2)COc2cc4c(cc2-3)CCC(OC(=O)C2CCC(C)N2C(=O)C(NC(=O)OC)C(C)C)C4=O)N(C(=O)OC(C)(C)C)C1 |
| InChI | InChI=1S/C44H55N3O13/c1-23(2)37(45-42(53)56-8)39(50)47-24(3)9-13-32(47)41(52)59-35-14-11-26-17-31-29-12-10-27(16-28(29)21-57-36(31)18-30(26)38(35)49)34(48)22-58-40(51)33-15-25(20-55-7)19-46(33)43(54)60-44(4,5)6/h10,12,16-18,23-25,32-33,35,37H,9,11,13-15,19-22H2,1-8H3,(H,45,53)/t24-,25-,32-,33-,35?,37-/m0/s1 |
| InChI Key | VIUSEVDFPVOBFC-UHFFFAOYSA-N |
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