| 英文别名 | Methyl (1R,3S)-1-(3-{[4-(2-fluorophenyl)-1-piperazinyl]methyl}-4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate |
| CAS号 | 1137263-99-0 |
| SMILES | COc1ccc(cc1CN2CCN(CC2)c3ccccc3F)[C@@H]4c5c(c6ccccc6[nH]5)C[C@H](N4)C(=O)OC |
| Inchi | InChI=1S/C31H33FN4O3/c1-38-28-12-11-20(17-21(28)19-35-13-15-36(16-14-35)27-10-6-4-8-24(27)32)29-30-23(18-26(34-29)31(37)39-2)22-7-3-5-9-25(22)33-30/h3-12,17,26,29,33-34H,13-16,18-19H2,1-2H3/t26-,29+/m0/s1 |
| InchiKey | NBQAXYMLTXNBOS-LITSAYRRSA-N |
| 分子式 Formula | C31H33FN4O3 |
| 分子量 Molecular Weight | 529 |
| 闪点 FP | 360.8±31.5 ℃ |
| 沸点 Boiling point | 672.9±55.0 ℃ at 760 mmHg |
| Polarizability极化度 | 59.1±0.5 10-24cm3 |
| 密度 Density | 1.3±0.1 g/cm3 |
| 蒸汽压 Vapor Pressure | 0.0±2.1 mmHg at 25℃ |
| 储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |
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