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Substance Name: Hexahydrophthalic acid
RN: 1687-30-5
InChIKey: QSAWQNUELGIYBC-UHFFFAOYSA-N

Note

  • A major metabolite of hexahydrophthalic anhydride.

Molecular Formula

  • C8-H12-O4

Molecular Weight

  • 172.179
 
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Names and Synonyms

Name of Substance

  • Hexahydrophthalic acid

Synonyms

  • 1,2-Benzenedicarboxylic acid, hexahydro-
  • 1,2-Cyclohexanedicarboxylic acid
  • EINECS 216-872-2
  • Hexahydroorthophthalic acid
  • Hexahydrophthalic acid
  • NSC 239117
  • Phthalic acid, hexahydro-

Systematic Names

  • 1,2-Cyclohexanedicarboxylic acid
  • Hexahydrophthalic acid

Registry Numbers

CAS Registry Number

  • 1687-30-5

System Generated Number

  • 0001687305

Structure Descriptors

InChI

1S/C8H12O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)

InChIKey

QSAWQNUELGIYBC-UHFFFAOYSA-N

Smiles

C1[C@@H]([C@@H](CCC1)C(O)=O)C(O)=O