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Substance Name: 1,4-Cyclohexanedicarboxylic acid, trans-
RN: 619-82-9
UNII: 18W55738KH
InChIKey: PXGZQGDTEZPERC-IZLXSQMJSA-N

Molecular Formula

  • C8-H12-O4

Molecular Weight

  • 172.179
 
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Names and Synonyms

Name of Substance

  • 1,4-Cyclohexanedicarboxylic acid, trans-

Synonyms

  • EINECS 210-614-2
  • UNII-18W55738KH

Systematic Name

  • trans-Hexahydroterephthalic acid

Registry Numbers

CAS Registry Number

  • 619-82-9

FDA UNII

  • 18W55738KH

System Generated Number

  • 0000619829

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)/t5-,6-

InChIKey

PXGZQGDTEZPERC-IZLXSQMJSA-N

Smiles

OC(=O)[C@H]1CC[C@H](C(=O)O)CC1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 312.5 deg C   EXP
log P (octanol-water) 0.950 (none)   EST
Water Solubility 800 mg/L 17 EXP
Atmospheric OH Rate Constant 1.11E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.