57801-42-0 ((Benzenesulfonamide, 4-[ethyl(2-methyl-2-propenyl)amino]-3,5-dinitro-)

CAS号:
57801-42-0
英文名称:
Benzenesulfonamide, 4-[ethyl(2-methyl-2-propenyl)amino]-3,5-dinitro-
分子式:
C12H16N4O6S
分子量:
344.343641281128

Benzenesulfonamide, 4-[ethyl(2-methyl-2-propenyl)amino]-3,5-dinitro-(57801-42-0)名称与标识符

名称

英文别名:
Benzenesulfonamide, 4-[ethyl(2-methyl-2-propenyl)amino]-3,5-dinitro-;Benzenesulfonamide, 4-[ethyl(2-methyl-2-propen-1-yl)amino]-3,5-dinitro-;

标识符

InChIKey:
ZFTLBALUPRSYPF-UHFFFAOYSA-N
Inchi:
1S/C12H16N4O6S/c1-4-14(7-8(2)3)12-10(15(17)18)5-9(23(13,21)22)6-11(12)16(19)20/h5-6H,2,4,7H2,1,3H3,(H2,13,21,22)
SMILES:
C1(S(N)(=O)=O)=CC([N+]([O-])=O)=C(N(CC)CC(C)=C)C([N+]([O-])=O)=C1

Benzenesulfonamide, 4-[ethyl(2-methyl-2-propenyl)amino]-3,5-dinitro-(57801-42-0)物化性质

实验特性

  • PSA : 149.68
  • 沸点 : 516.2±60.0 °C(Predicted)
  • 酸度系数(pKa) : 9.10±0.60(Predicted)
  • 密度 : 1.428±0.06 g/cm3(Predicted)

计算特性

  • 精确分子量 : 344.07918