179898-26-1 ((Carbamic acid, (2-methyl-3-nitrophenyl)-, 1,1-dimethylethyl ester)

CAS号:
179898-26-1
英文名称:
Carbamic acid, (2-methyl-3-nitrophenyl)-, 1,1-dimethylethyl ester
分子式:
C12H16N2O4
分子量:
252.266443252563

Carbamic acid, (2-methyl-3-nitrophenyl)-, 1,1-dimethylethyl ester(179898-26-1)名称与标识符

名称

英文别名:
Carbamic acid, (2-methyl-3-nitrophenyl)-, 1,1-dimethylethyl ester;Carbamic acid, N-(2-methyl-3-nitrophenyl)-, 1,1-dimethylethyl ester;

标识符

InChIKey:
JEFLGMHMBRFWIE-UHFFFAOYSA-N
Inchi:
1S/C12H16N2O4/c1-8-9(6-5-7-10(8)14(16)17)13-11(15)18-12(2,3)4/h5-7H,1-4H3,(H,13,15)
SMILES:
C(OC(C)(C)C)(=O)NC1=CC=CC([N+]([O-])=O)=C1C

Carbamic acid, (2-methyl-3-nitrophenyl)-, 1,1-dimethylethyl ester(179898-26-1)物化性质

实验特性

  • PSA : 81.47
  • 沸点 : 304.5±35.0 °C(Predicted)
  • 酸度系数(pKa) : 12.95±0.70(Predicted)
  • 密度 : 1?+-.0.06 g/cm3(Predicted)

计算特性

  • 精确分子量 : 252.11108