17086-53-2 ((Androsta-1,4-diene-3,17-diol, (3a,17b)-)

CAS号:
17086-53-2
英文名称:
Androsta-1,4-diene-3,17-diol, (3a,17b)-
分子式:
C19H28O2
分子量:
288.424426078796

Androsta-1,4-diene-3,17-diol, (3a,17b)-(17086-53-2)名称与标识符

名称

英文别名:
Androsta-1,4-diene-3,17-diol, (3a,17b)-;Androsta-1,4-diene-3,17-diol, (3α,17β)- (9CI);

标识符

InChIKey:
CNCCUWWNXBUIDS-KYQPOWKGSA-N
Inchi:
1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,11,13-17,20-21H,3-6,8,10H2,1-2H3/t13-,14+,15+,16+,17+,18+,19+/m1/s1
SMILES:
[C@H]1(O)C=C2[C@](C)(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](O)CC3)CC2

Androsta-1,4-diene-3,17-diol, (3a,17b)-(17086-53-2)物化性质

实验特性

  • 沸点 : 437.6±45.0 °C(Predicted)
  • 酸度系数(pKa) : 13.46±0.70(Predicted)
  • 密度 : 1.14±0.1 g/cm3(Predicted)