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Substance Name: 1,4-Cyclohexanedicarboxylic acid
RN: 1076-97-7
UNII: 13LBH83IU4
InChIKey: PXGZQGDTEZPERC-UHFFFAOYSA-N

Molecular Formula

  • C8-H12-O4

Molecular Weight

  • 172.179
 
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Names and Synonyms

Name of Substance

  • 1,4-Cyclohexanedicarboxylic acid

Synonyms

  • 1,4-Dicarboxycyclohexane
  • EC 214-068-6
  • EINECS 214-068-6
  • Hexahydroterephthalic acid
  • Terephthalic acid, hexahydro-
  • UNII-13LBH83IU4

Systematic Names

  • 1,4-Cyclohexanedicarboxylic acid
  • Cyclohexane-1,4-dicarboxylic acid

Registry Numbers

CAS Registry Number

  • 1076-97-7

FDA UNII

  • 13LBH83IU4

System Generated Number

  • 0001076977

Structure Descriptors

InChI

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

InChIKey

PXGZQGDTEZPERC-UHFFFAOYSA-N

Smiles

C1(C(O)=O)CCC(C(O)=O)CC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 3023mg/kg (3023mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 19, Pg. 503, 1980.