Chem
J-GLOBAL ID：200907079749323057   Nikkaji number：J2.090.130F

Terephthalic acid bis[4-[[[(1S)-2β-isopropyl-5α-methylcyclohexane]-1α-yloxy]carbonyl]phenyl] ester

テレフタル酸ビス[4-[[[(1S)-2β-イソプロピル-5α-メチルシクロヘキサン]-1α-イルオキシ]カルボニル]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： C42H50O8
Molecular formula furigana： C42-H50-O8
Molecular weight： 682.854
InChI： InChI=1S/C42H50O8/c1-25(2)35-21-7-27(5)23-37(35)49-41(45)31-13-17-33(18-14-31)47-39(43)29-9-11-30(12-10-29)40(44)48-34-19-15-32(16-20-34)42(46)50-38-24-28(6)8-22-36(38)26(3)4/h9-20,25-28,35-38H,7-8,21-24H2,1-6H3/t27-,28-,35+,36+,37-,38-/m0/s1
InChI key： OPRLGPLYUHANFL-RGYJCVBGSA-N
SMILES： CC(C)[C@H]1CC[C@H](C)C[C@@H]1OC(=O)c1ccc(OC(=O)c2ccc(cc2)C(=O)Oc2ccc(cc2)C(=O)O[C@H]2C[C@@H](C)CC[C@@H]2C(C)C)cc1
Systematic name  (4)：
  • 4,4′-[p-フェニレンビス(カルボニルオキシ)]ビス安息香酸ビス[(1S,2R,5S)-2-イソプロピル-5-メチルシクロヘキシル]
  • テレフタル酸ビス[4-[[[(1S)-2β-イソプロピル-5α-メチルシクロヘキサン]-1α-イルオキシ]カルボニル]フェニル]
  • 1,4-ビス[4-({[(1S,2R,5S)-5-メチル-2-(プロパン-2-イル)シクロヘキシル]オキシ}カルボニル)フェニル] ベンゼン-1,4-ジカルボキシラート
  • 1,4-bis[4-({[(1S,2R,5S)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}carbonyl)phenyl] benzene-1,4-dicarboxylate
Other name (2)：
  • 4,4′-[p-Phenylenebis(carbonyloxy)]bisbenzoic acid bis[(1S,2R,5S)-2-isopropyl-5-methylcyclohexyl] ester
  • Terephthalic acid bis[4-[[[(1S)-2β-isopropyl-5α-methylcyclohexane]-1α-yloxy]carbonyl]phenyl] ester
Thsaurus map：
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