中文别名 | Cholesta-?1,?4,?6-?trien-?3-?one(3464-60-6) |
英文别名 | (3464-60-6);Cholesta-?1,?4,?6-?trien-?3-?one |
CAS号 | 3464-60-6 |
SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=CC4=CC(=O)C=C[C@]34C)C |
Inchi | InChI=1S/C27H40O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9-10,13,15,17-19,22-25H,6-8,11-12,14,16H2,1-5H3/t19-,22+,23-,24+,25+,26+,27-/m1/s1 |
InchiKey | NIJCHQWGAFQPFT-GYKMGIIDSA-N |
分子式 Formula | C27H40O |
分子量 Molecular Weight | 380.606 |
闪点 FP | 209.8±18.1 ℃ |
沸点 Boiling point | 495.1±25.0 ℃ at 760 mmHg |
Polarizability极化度 | 46.9±0.5 10-24cm3 |
密度 Density | 1.0±0.1 g/cm3 |
蒸汽压 Vapor Pressure | 0.0±1.3 mmHg at 25℃ |
溶解度Solubility | Chloroform, Dichloromethane, Ethyl Acetate |
储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |