rel-1,2-Bis[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl] ethanedioate

CAS Registry Number®

68889-96-3

CAS Name

rel-1,2-Bis[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl] ethanedioate

Molecular Formula

C22H38O4

Molecular Mass

366.53

Cite this Page

rel-1,2-Bis[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl] ethanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=68889-96-3 (retrieved 2025-01-11) (CAS RN: 68889-96-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C22H38O4/c1-13(2)17-9-7-15(5)11-19(17)25-21(23)22(24)26-20-12-16(6)8-10-18(20)14(3)4/h13-20H,7-12H2,1-6H3/t15-,16-,17+,18+,19-,20-/s2

InChIKey

InChIKey=ZQJMKLXHLODZMT-XGGIQGJTNA-N

SMILES

O(C(C(O[C@@H]1[C@@H](C(C)C)CC[C@H](C)C1)=O)=O)[C@@H]2[C@@H](C(C)C)CC[C@H](C)C2

Canonical SMILES

O=C(OC1CC(C)CCC1C(C)C)C(=O)OC2CC(C)CCC2C(C)C

Other Names for this Substance

  • Ethanedioic acid, 1,2-bis[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl] ester, rel-
  • Ethanedioic acid, bis[5-methyl-2-(1-methylethyl)cyclohexyl] ester, [1α(1R*,2S*,5R*),2β,5α]-(±)-
  • Ethanedioic acid, bis[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl] ester, rel-
  • rel-1,2-Bis[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl] ethanedioate
  • Ethanedioic acid, bis[5-methyl-2-(1-methylethyl)cyclohexyl] ester, [1α(1R*,2S*,5R*),2β,5α]-

CAS INSIGHTSTM
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