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Substance Name: 1,2-Cyclohexanediol, trans-
RN: 1460-57-7
UNII: 89G7G95Z1Y
InChIKey: PFURGBBHAOXLIO-PHDIDXHHSA-N

Molecular Formula

  • C6-H12-O2

Molecular Weight

  • 116.159
 
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Names and Synonyms

Name of Substance

  • 1,2-Cyclohexanediol, trans-

Synonyms

  • AI3-06458
  • EINECS 215-956-6
  • NSC 34836
  • trans-1,2-Cyclohexanediol
  • trans-1,2-Dihydroxycyclohexane
  • UNII-89G7G95Z1Y

Systematic Names

  • 1,2-Cyclohexanediol, (1R,2R)-rel-
  • trans-Cyclohexane-1,2-diol

Registry Numbers

CAS Registry Number

  • 1460-57-7

FDA UNII

  • 89G7G95Z1Y

System Generated Number

  • 0001460577

Structure Descriptors

InChI

1S/C6H12O2/c7-5-3-1-2-4-6(5)8/h5-8H,1-4H2/t5-,6-/m1/s1

InChIKey

PFURGBBHAOXLIO-PHDIDXHHSA-N

Smiles

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

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 101-104 deg C   EXP
log P (octanol-water) 0.08 (none)   EXP
Water Solubility 6.59E+04 mg/L 25 EST
Vapor Pressure 0.011 mm Hg 25 EST
Henry's Law Constant 1.79E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.65E-11 cm3/molecule-sec 25 EST

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