Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- Cc1ccc(-c2ccc(S(=O)(=O)Cl)cc2)cc1
- InChIKey
- DBYXACYHGMSPMQ-UHFFFAOYSA-N
- 分子式
- C13H11ClO2S
- 平均分子量
- 266.74 g/mol
- 单同位素质量
- 266.0168285
COMPUTED
结构计算性质
- XLogP
- 3.9
- 极性表面积
- 42.5 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 2
- 重原子
- 17
- 形式电荷
- 0
- 复杂度
- 331
物化、安全与法规信息正在同步。
ALIASES
名称与别名
4'-Methyl-[1,1'-biphenyl]-4-sulphonyl chloride4'-Methyl-(1,1'-biphenyl)-4-sulphonyl chlorideRefChem:506188638-951-4101366-51-24'-Methylbiphenyl-4-sulfonyl chloride4-(4-methylphenyl)benzenesulfonyl Chloride4'-methyl-[1,1'-biphenyl]-4-sulfonyl chloride[1,1'-Biphenyl]-4-sulfonyl chloride, 4'-methyl-MFCD016319224'-Methyl[1,1'-Biphenyl]-4-Sulfonyl Chloride4-(p-tolyl)benzenesulfonyl chloride4'-methyl-biphenyl-4-sulfonyl chlorideSCHEMBL995781F9995-0462DTXSID40383384DBYXACYHGMSPMQ-UHFFFAOYSA-NAR2096AKOS0008137724'-(methyl)biphenyl-4-sulfonyl chloride
REACTIONS
相关反应
uspto-grants-2012_04 · 10.6084/m9.figshare.5104873.v1 · US08163781B2
查看