Chem
J-GLOBAL ID：200907039610611641
Nikkaji number：J2.762.477D
4-(Propylthio)benzoic acid
4-(プロピルチオ)安息香酸
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： C10H12O2S
Molecular formula furigana： C10-H12-O2-S
Molecular weight： 196.260
InChI：
InChI=1S/C10H12O2S/c1-2-7-13-9-5-3-8(4-6-9)10(11)12/h3-6H,2,7H2,1H3,(H,11,12)
InChI key：
BKWLRLMBMBHNJG-UHFFFAOYSA-N
SMILES：
CCCSc1ccc(cc1)C(=O)O
Systematic name (3)：
- 4-(プロピルチオ)安息香酸
- 4-(プロピルスルファニル)安息香酸
- 4-(propylsulfanyl)benzoic acid
- 4-(Propylthio)benzoic acid
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