Chem
J-GLOBAL ID：200907050278958210   Nikkaji number：J923.989H

1α,4β-Cyclohexanedicarboxylic acid bis[4-(octyloxy)phenyl] ester

1α,4β-シクロヘキサンジカルボン酸ビス[4-(オクチルオキシ)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： C36H52O6
Molecular formula furigana： C36-H52-O6
Molecular weight： 580.806
InChI： InChI=1S/C36H52O6/c1-3-5-7-9-11-13-27-39-31-19-23-33(24-20-31)41-35(37)29-15-17-30(18-16-29)36(38)42-34-25-21-32(22-26-34)40-28-14-12-10-8-6-4-2/h19-26,29-30H,3-18,27-28H2,1-2H3/t29-,30-
InChI key： CPSLWNCXMWZMBN-WXUXXXNLSA-N
SMILES： CCCCCCCCOc1ccc(OC(=O)[C@H]2CC[C@@H](CC2)C(=O)Oc2ccc(OCCCCCCCC)cc2)cc1
Systematic name  (4)：
  • 1α,4β-シクロヘキサンジカルボン酸ビス[4-(オクチルオキシ)フェニル]
  • シクロヘキサン-1α,4β-ジカルボン酸ビス[4-(オクチルオキシ)フェニル]
  • 1,4-ビス[4-(オクチルオキシ)フェニル] (1r,4r)-シクロヘキサン-1,4-ジカルボキシラート
  • 1,4-bis[4-(octyloxy)phenyl] (1r,4r)-cyclohexane-1,4-dicarboxylate
Other name (2)：
  • 1α,4β-Cyclohexanedicarboxylic acid bis[4-(octyloxy)phenyl] ester
  • Cyclohexane-1α,4β-dicarboxylic acid bis[4-(octyloxy)phenyl] ester
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