374802-75-2 ((2H-1-Benzopyran-2-one,7-(diethylamino)-3-[3-(7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-oxo-1-propenyl]-)

CAS号:
374802-75-2
英文名称:
2H-1-Benzopyran-2-one,7-(diethylamino)-3-[3-(7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-oxo-1-propenyl]-
分子式:
C25H21NO6
分子量:
431.437347173691

2H-1-Benzopyran-2-one,7-(diethylamino)-3-[3-(7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-oxo-1-propenyl]-(374802-75-2)名称与标识符

名称

英文别名:
2H-1-Benzopyran-2-one,7-(diethylamino)-3-[3-(7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-oxo-1-propenyl]-;2H-1-Benzopyran-2-one, 7-(diethylamino)-3-[3-(7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-oxo-1-propen-1-yl]-;

标识符

InChIKey:
JLZJRUKMZFVMDP-UHFFFAOYSA-N
Inchi:
1S/C25H21NO6/c1-3-26(4-2)18-8-5-15-11-17(24(29)31-22(15)13-18)7-10-21(28)20-12-16-6-9-19(27)14-23(16)32-25(20)30/h5-14,27H,3-4H2,1-2H3
SMILES:
C1(=O)OC2=CC(N(CC)CC)=CC=C2C=C1C=CC(C1=CC2=CC=C(O)C=C2OC1=O)=O

2H-1-Benzopyran-2-one,7-(diethylamino)-3-[3-(7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-3-oxo-1-propenyl]-(374802-75-2)物化性质

实验特性

  • PSA : 93.14
  • 沸点 : 706.4±60.0 °C(Predicted)
  • 酸度系数(pKa) : 7.24±0.20(Predicted)
  • 密度 : 1.413±0.06 g/cm3(Predicted)

计算特性

  • 精确分子量 : 431.13693