Chem
J-GLOBAL ID：200907019619107716
Nikkaji number：J182.139C
Phenylmethanesulfonic acid
フェニルメタンスルホン酸
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C7H8O3S
Molecular formula furigana： C7-H8-O3-S
Molecular weight： 172.200
InChI：
InChI=1S/C7H8O3S/c8-11(9,10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,8,9,10)
InChI key：
NIXKBAZVOQAHGC-UHFFFAOYSA-N
SMILES：
OS(=O)(=O)Cc1ccccc1
Systematic name (3)：
- フェニルメタンスルホン酸
- ベンゼンメタンスルホン酸
- phenylmethanesulfonic acid
- Benzenemethanesulfonic acid
- Phenylmethanesulfonic acid
Regulation number (2)：
- EINECS2028976
- TSCA(100-87-8)
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