Chem
J-GLOBAL ID：200907044381473950   Nikkaji number：J5.116K

1-Octanethiol

1-オクタンチオール
Substance type：
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
Molecular formula： C8H18S
Molecular formula furigana： C8-H18-S
Molecular weight： 146.290
InChI： InChI=1S/C8H18S/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
InChI key： KZCOBXFFBQJQHH-UHFFFAOYSA-N
SMILES： CCCCCCCCS
Systematic name  (3)：
  • 1-オクタンチオール
  • オクタン-1-チオール
  • octane-1-thiol
Other name (8)：
  • オクチルメルカプタン
  • Octane-1-thiol
  • Octyl mercaptan
  • n-オクチルメルカプタン
  • n-Octyl mercaptan
Show all
CAS registry number： 111-88-6
Regulation number (3)：
  • (2)-464
  • EINECS2039181
  • TSCA(111-88-6)
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