105037-82-9 (3,4-菲二酮,5,6,7,8-四氢-5-羟基-8,8-二甲基-2-(1-甲基乙基)-,(R)-,3,4-Phenanthrenedione, 5,6,7,8-tetrahydro-5-hydroxy-8,8-dimethyl-2-(1-methylethyl)-, (R)-)

CAS号:
105037-82-9
中文名称:
3,4-菲二酮,5,6,7,8-四氢-5-羟基-8,8-二甲基-2-(1-甲基乙基)-,(R)-
英文名称:
3,4-Phenanthrenedione, 5,6,7,8-tetrahydro-5-hydroxy-8,8-dimethyl-2-(1-methylethyl)-, (R)-
分子式:
C19H22O3
分子量:
298.376185894012

3,4-菲二酮,5,6,7,8-四氢-5-羟基-8,8-二甲基-2-(1-甲基乙基)-,(R)-(105037-82-9)名称与标识符

名称

英文别名:
3,4-Phenanthrenedione, 5,6,7,8-tetrahydro-5-hydroxy-8,8-dimethyl-2-(1-methylethyl)-, (R)-;3,4-Phenanthrenedione, 5,6,7,8-tetrahydro-5-hydroxy-8,8-dimethyl-2-(1-methylethyl)-, (R)- (9CI);1-Hydroxydanshinones;

标识符

InChIKey:
PGMGYRXQLKELLG-CQSZACIVSA-N
Inchi:
1S/C19H22O3/c1-10(2)12-9-11-5-6-13-16(15(11)18(22)17(12)21)14(20)7-8-19(13,3)4/h5-6,9-10,14,20H,7-8H2,1-4H3/t14-/m1/s1
SMILES:
C1C2=C(C3=C(C=C2)C(C)(C)CC[C@H]3O)C(=O)C(=O)C=1C(C)C

3,4-菲二酮,5,6,7,8-四氢-5-羟基-8,8-二甲基-2-(1-甲基乙基)-,(R)-(105037-82-9)物化性质

实验特性

  • 沸点 : 452.6±45.0 °C(Predicted)
  • 酸度系数(pKa) : 14.24±0.60(Predicted)
  • 密度 : 1.170±0.06 g/cm3(Predicted)