1606-56-0 ((3H-Pyrazol-3-one,4,4'-ethylidenebis[1,2-dihydro-1,5-dimethyl-2-phenyl-)

CAS号:
1606-56-0
英文名称:
3H-Pyrazol-3-one,4,4'-ethylidenebis[1,2-dihydro-1,5-dimethyl-2-phenyl-
分子式:
C24H26N4O2
分子量:
402.488845348358

3H-Pyrazol-3-one,4,4'-ethylidenebis[1,2-dihydro-1,5-dimethyl-2-phenyl-(1606-56-0)名称与标识符

名称

英文别名:
44P;Antipyrine,4,4'-ethylidenedi- (6CI,7CI,8CI);Diantipyrylmethylmethane;Methyldiantipyrylmethane;4-[1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)ethyl]-1,5-dimethyl-2-phenylpyrazol-3-one;3H-Pyrazol-3-one, 4,4'-ethylidenebis[1,2-dihydro-1,5-dimethyl-2-phenyl-;

标识符

InChIKey:
USRVZLIBVDEXDS-UHFFFAOYSA-N
Inchi:
1S/C24H26N4O2/c1-16(21-17(2)25(4)27(23(21)29)19-12-8-6-9-13-19)22-18(3)26(5)28(24(22)30)20-14-10-7-11-15-20/h6-16H,1-5H3
SMILES:
C(C1=C(C)N(C)N(C2=CC=CC=C2)C1=O)(C1=C(C)N(C)N(C2=CC=CC=C2)C1=O)C

3H-Pyrazol-3-one,4,4'-ethylidenebis[1,2-dihydro-1,5-dimethyl-2-phenyl-(1606-56-0)物化性质

实验特性

  • PSA : 47.1
  • 折射率 : 1.6000 (estimate)
  • 沸点 : 524.62°C (rough estimate)
  • 溶解性 : 449.8mg/L(20 ºC)
  • 酸度系数(pKa) : 1.21±0.65(Predicted)
  • 密度 : 1.1813 (rough estimate)

计算特性

  • 精确分子量 : 402.20578