15436-23-4 ((Benzoic acid, 3-[S-methyl-N-[(4-methylphenyl)sulfonyl]sulfinimidoyl]-)

CAS号:
15436-23-4
英文名称:
Benzoic acid, 3-[S-methyl-N-[(4-methylphenyl)sulfonyl]sulfinimidoyl]-
分子式:
C15H15NO4S2
分子量:
337.413901567459

Benzoic acid, 3-[S-methyl-N-[(4-methylphenyl)sulfonyl]sulfinimidoyl]-(15436-23-4)名称与标识符

名称

英文别名:
Benzoic acid, 3-[S-methyl-N-[(4-methylphenyl)sulfonyl]sulfinimidoyl]-;3-[Methyl-(toluol-4-sulfonylimino)-λ4-sulfanyl]-benzoesaeure;N-(Toluol-sulfonyl-(4))-S-methyl-S-(3-carboxy-phenyl)-sulfimin;S-Methyl-S-(3-carboxy-phenyl)-N-(p-toluolsulfonyl)-sulfimid;S-Methyl-S-(3-carboxy-phenyl)-N-p-tolylsulfonyl-sulfilimin;S-Methyl-S-(3-carboxy-phenyl)-N-p-tolyl-sulfonyl-sulfilimin;3-{methyl[(4-methylphenyl)sulfonyl]sulfinimidoyl}benzoic acid;

标识符

InChIKey:
AMEFRYLURVIIQJ-UHFFFAOYSA-N
Inchi:
1S/C15H15NO4S2/c1-11-6-8-14(9-7-11)22(19,20)16-21(2)13-5-3-4-12(10-13)15(17)18/h3-10H,1-2H3,(H,17,18)
SMILES:
S(=O)(=O)(C1C=CC(=CC=1)C)N=S(C)C1C=CC=C(C=1)C(O)=O

Benzoic acid, 3-[S-methyl-N-[(4-methylphenyl)sulfonyl]sulfinimidoyl]-(15436-23-4)物化性质

实验特性

  • LogP : 4.60410
  • PSA : 111.39000

计算特性

  • 精确分子量 : 337.04400

Benzoic acid, 3-[S-methyl-N-[(4-methylphenyl)sulfonyl]sulfinimidoyl]-(15436-23-4)上下游