Chem
J-GLOBAL ID：200907019285767388   Nikkaji number：J2.213.925H

1-(Octyloxy)-4-ethynylbenzene-2,6-dimethanol

1-(オクチルオキシ)-4-エチニルベンゼン-2,6-ジメタノール
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： C18H26O3
Molecular formula furigana： C18-H26-O3
Molecular weight： 290.403
InChI： InChI=1S/C18H26O3/c1-3-5-6-7-8-9-10-21-18-16(13-19)11-15(4-2)12-17(18)14-20/h2,11-12,19-20H,3,5-10,13-14H2,1H3
InChI key： BDHKKUFFLIPMPF-UHFFFAOYSA-N
SMILES： CCCCCCCCOc1c(CO)cc(cc1CO)C#C
Systematic name  (5)：
  • 5-エチニル-2-(オクチルオキシ)ベンゼン-1,3-ジメタノール
  • 2-(オクチルオキシ)-5-エチニルベンゼン-1,3-ジメタノール
  • 1-(オクチルオキシ)-4-エチニルベンゼン-2,6-ジメタノール
  • [5-エチニル-3-(ヒドロキシメチル)-2-(オクチルオキシ)フェニル]メタノール
  • [5-ethynyl-3-(hydroxymethyl)-2-(octyloxy)phenyl]methanol
Other name (3)：
  • 5-Ethynyl-2-(octyloxy)benzene-1,3-dimethanol
  • 2-(Octyloxy)-5-ethynylbenzene-1,3-dimethanol
  • 1-(Octyloxy)-4-ethynylbenzene-2,6-dimethanol
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