rel-1,2-Dimethyl (1S,2R)-1,2-cyclohexanedicarboxylate

CAS Registry Number®

1687-29-2
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CAS Name

rel-1,2-Dimethyl (1S,2R)-1,2-cyclohexanedicarboxylate

Molecular Formula

C10H16O4

Molecular Mass

200.23

Cite this Page

rel-1,2-Dimethyl (1S,2R)-1,2-cyclohexanedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1687-29-2 (retrieved 2024-09-08) (CAS RN: 1687-29-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    110-111 °C @ Press: 5 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1/C10H16O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h7-8H,3-6H2,1-2H3/t7-,8+

InChIKey

InChIKey=AIACXWOETVLBIA-OCAPTIKFNA-N

SMILES

C(OC)(=O)[C@H]1[C@@H](C(OC)=O)CCCC1

Canonical SMILES

O=C(OC)C1CCCCC1C(=O)OC

Other Names for this Substance

  • 1,2-Cyclohexanedicarboxylic acid, 1,2-dimethyl ester, (1S,2R)-rel-
  • 1,2-Cyclohexanedicarboxylic acid, dimethyl ester, cis-
  • 1,2-Cyclohexanedicarboxylic acid, dimethyl ester, (1R,2S)-rel-
  • rel-1,2-Dimethyl (1S,2R)-1,2-cyclohexanedicarboxylate
  • Dimethyl cis-1,2-cyclohexanedicarboxylate

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