Chem
J-GLOBAL ID：201507012986772711   Nikkaji number：J3.445.466C

3,4,5-Tris(octyloxy)benzenethiol

3,4,5-トリス(オクチルオキシ)ベンゼンチオール
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： C30H54O3S
Molecular formula furigana： C30-H54-O3-S
Molecular weight： 494.820
InChI： InChI=1S/C30H54O3S/c1-4-7-10-13-16-19-22-31-28-25-27(34)26-29(32-23-20-17-14-11-8-5-2)30(28)33-24-21-18-15-12-9-6-3/h25-26,34H,4-24H2,1-3H3
InChI key： HSETVHYTKMRXHH-UHFFFAOYSA-N
SMILES： CCCCCCCCOc1cc(S)cc(OCCCCCCCC)c1OCCCCCCCC
Systematic name  (3)：
  • 3,4,5-トリス(オクチルオキシ)ベンゼンチオール
  • 3,4,5-トリス(オクチルオキシ)ベンゼン-1-チオール
  • 3,4,5-tris(octyloxy)benzene-1-thiol
Other name (1)：
  • 3,4,5-Tris(octyloxy)benzenethiol
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