2381045-33-4 ((2H-Isoindole-2-carboxylic acid, 5-bromo-6-fluoro-1,3-dihydro-3-methyl-1-oxo-, 1,1-dimethylethyl ester)

CAS号:
2381045-33-4
英文名称:
2H-Isoindole-2-carboxylic acid, 5-bromo-6-fluoro-1,3-dihydro-3-methyl-1-oxo-, 1,1-dimethylethyl ester
分子式:
C14H15BrFNO3
分子量:
344.176206827164

2H-Isoindole-2-carboxylic acid, 5-bromo-6-fluoro-1,3-dihydro-3-methyl-1-oxo-, 1,1-dimethylethyl ester(2381045-33-4)名称与标识符

名称

英文别名:
2H-Isoindole-2-carboxylic acid, 5-bromo-6-fluoro-1,3-dihydro-3-methyl-1-oxo-, 1,1-dimethylethyl ester;

标识符

InChIKey:
BTIZKPAZMFSQTR-UHFFFAOYSA-N
Inchi:
1S/C14H15BrFNO3/c1-7-8-5-10(15)11(16)6-9(8)12(18)17(7)13(19)20-14(2,3)4/h5-7H,1-4H3
SMILES:
CC1N(C(C2=CC(=C(C=C21)Br)F)=O)C(=O)OC(C)(C)C

2H-Isoindole-2-carboxylic acid, 5-bromo-6-fluoro-1,3-dihydro-3-methyl-1-oxo-, 1,1-dimethylethyl ester(2381045-33-4)物化性质

实验特性

  • 沸点 : 372.750±52.00 °C(Press: 760.00 Torr)(predicted)
  • 酸度系数(pKa) : -3.149±0.40(predicted)
  • 密度 : 1.473±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)