39248-95-8 ((Benzenecarbothioic acid, 4-methyl-, S-(4-methylphenyl) ester)

CAS号:
39248-95-8
英文名称:
Benzenecarbothioic acid, 4-methyl-, S-(4-methylphenyl) ester
分子式:
C15H14OS
分子量:
242.336062908173

Benzenecarbothioic acid, 4-methyl-, S-(4-methylphenyl) ester(39248-95-8)名称与标识符

名称

英文别名:
Benzenecarbothioic acid, 4-methyl-, S-(4-methylphenyl) ester;4-Methyl-thiobenzoesaeure-S-p-tolylester;4-methyl-thiobenzoic acid S-p-tolyl ester;S-(p-tolyl) 4-methylbenzothioate;S-(p-tolyl) p-methylbenzothioathe;S-p-tolyl 4-methylbenzothioate;S-p-tolyl 4-methylthiobenzoate;

标识符

InChIKey:
VQHCJCMQYVTAGY-UHFFFAOYSA-N
Inchi:
1S/C15H14OS/c1-11-3-7-13(8-4-11)15(16)17-14-9-5-12(2)6-10-14/h3-10H,1-2H3
SMILES:
C1(C(SC2=CC=C(C)C=C2)=O)=CC=C(C)C=C1

Benzenecarbothioic acid, 4-methyl-, S-(4-methylphenyl) ester(39248-95-8)物化性质

实验特性

  • LogP : 4.23590
  • PSA : 42.37000
  • 沸点 : 363.5±35.0 °C(Predicted)
  • 熔点 : 123.8 °C(Solv: acetic acid (64-19-7))
  • 密度 : 1.15±0.1 g/cm3(Predicted)

计算特性

  • 精确分子量 : 242.07700

Benzenecarbothioic acid, 4-methyl-, S-(4-methylphenyl) ester(39248-95-8)上下游