Chem
J-GLOBAL ID：200907002646914453   Nikkaji number：J1.689.408G

4-Pentylcyclohexanecarboxylic acid 4-ethynylphenyl ester

4-ペンチルシクロヘキサンカルボン酸4-エチニルフェニル
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： C20H26O2
Molecular formula furigana： C20-H26-O2
Molecular weight： 298.426
InChI： InChI=1S/C20H26O2/c1-3-5-6-7-17-8-12-18(13-9-17)20(21)22-19-14-10-16(4-2)11-15-19/h2,10-11,14-15,17-18H,3,5-9,12-13H2,1H3
InChI key： KGSYRERXPFFXDN-UHFFFAOYSA-N
SMILES： CCCCCC1CCC(CC1)C(=O)Oc1ccc(cc1)C#C
Systematic name  (3)：
  • 4-ペンチルシクロヘキサンカルボン酸4-エチニルフェニル
  • 4-エチニルフェニル 4-ペンチルシクロヘキサン-1-カルボキシラート
  • 4-ethynylphenyl 4-pentylcyclohexane-1-carboxylate
Other name (1)：
  • 4-Pentylcyclohexanecarboxylic acid 4-ethynylphenyl ester
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