1,2,3,4,5,6-Cyclohexanehexacarboxylic acid, hydrate (1:1), (1α,2α,3α,4α,5α,6α)-

CAS Registry Number®

207121-44-6

CAS Name

1,2,3,4,5,6-Cyclohexanehexacarboxylic acid, hydrate (1:1), (1α,2α,3α,4α,5α,6α)-

Molecular Formula

C12H12O12.H2O

Cite this Page

1,2,3,4,5,6-Cyclohexanehexacarboxylic acid, hydrate (1:1), (1α,2α,3α,4α,5α,6α)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=207121-44-6 (retrieved 2024-11-21) (CAS RN: 207121-44-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C12H12O12.H2O/c13-7(14)1-2(8(15)16)4(10(19)20)6(12(23)24)5(11(21)22)3(1)9(17)18;/h1-6H,(H,13,14)(H,15,16)(H,17,18)(H,19,20)(H,21,22)(H,23,24);1H2/t1-,2+,3-,4+,5-,6+;

InChIKey

InChIKey=RGICGFJCIFFIQJ-PWRMZBPBNA-N

SMILES

C(O)(=O)[C@H]1[C@@H](C(O)=O)[C@@H](C(O)=O)[C@@H](C(O)=O)[C@@H](C(O)=O)[C@H]1C(O)=O.O

Canonical SMILES

O=C(O)C1C(C(=O)O)C(C(=O)O)C(C(=O)O)C(C(=O)O)C1C(=O)O.O

Other Names for this Substance

  • 1,2,3,4,5,6-Cyclohexanehexacarboxylic acid, hydrate (1:1), (1α,2α,3α,4α,5α,6α)-
  • 1,2,3,4,5,6-Cyclohexanehexacarboxylic acid, monohydrate, (1α,2α,3α,4α,5α,6α)-