HIT ID: HIT212717326
Cas No: 5819-64-7
分子式: C13H21NO3S
分子量: 271.38
常用名: m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-
常用名: m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 1.357561
IUPAC: 3-(methanesulfonylmethyl)-4-(pentyloxy)aniline
IUPAC: 3-(methanesulfonylmethyl)-4-(pentyloxy)aniline
SMILES: CCCCCOc1ccc(N)cc1CS(C)(=O)=O
SMILES: CCCCCOc1ccc(N)cc1CS(C)(=O)=O
InChI key: FSBCLKOMNYSLPR-UHFFFAOYSA-N