| 英文别名 | 1346617-34-2;(S)-PA 824-d4 (Pretomanid-d4) |
| CAS号 | 1346617-34-2 |
| SMILES | [2H]C1([C@@H](COc2n1cc(n2)[N+](=O)[O-])OC([2H])([2H])c3ccc(cc3)OC(F)(F)F)[2H] |
| Inchi | InChI=1S/C14H12F3N3O5/c15-14(16,17)25-10-3-1-9(2-4-10)7-23-11-5-19-6-12(20(21)22)18-13(19)24-8-11/h1-4,6,11H,5,7-8H2/t11-/m0/s1/i5D2,7D2 |
| InchiKey | ZLHZLMOSPGACSZ-QXCFPOKCSA-N |
| 分子式 Formula | C14H8D4F3N3O5 |
| 分子量 Molecular Weight | 363.282 |
| 闪点 FP | 233.4±31.5 ℃ |
| 熔点 Melting point | 145-150℃ |
| 沸点 Boiling point | 462.3±55.0 ℃ at 760 mmHg |
| Polarizability极化度 | 30.3±0.5 10-24cm3 |
| 密度 Density | 1.6±0.1 g/cm3 |
| 蒸汽压 Vapor Pressure | 0.0±1.1 mmHg at 25℃ |
| 溶解度Solubility | DMSO (Slightly), Methanol (Slightly, Heated) |
| 储藏条件 Storage conditions | Refrigerator |
m.cnreagent.com