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Substance Name: 1,4-Dimethylcyclohexane
RN: 589-90-2
UNII: 4C75P10R7G
InChIKey: QRMPKOFEUHIBNM-UHFFFAOYSA-N

Molecular Formula

  • C8-H16

Molecular Weight

  • 112.214
 
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Names and Synonyms

Name of Substance

  • 1,4-Dimethylcyclohexane

Synonyms

  • 1,4-Dimethylcyclohexane
  • EINECS 209-663-2
  • Hexahydroxylene
  • NSC 44845
  • UNII-4C75P10R7G

Systematic Names

  • 1,4-Dimethylcyclohexane
  • Cyclohexane, 1,4-dimethyl-
  • Cyclohexane, 1,4-dimethyl- (8CI)(9CI)

Superlist Names

  • 1,4-Dimethylcyclohexane
  • Cyclohexane, 1,4-dimethyl-

Registry Numbers

CAS Registry Number

  • 589-90-2

FDA UNII

  • 4C75P10R7G

System Generated Number

  • 0000589902

Structure Descriptors

InChI

1S/C8H16/c1-7-3-5-8(2)6-4-7/h7-8H,3-6H2,1-2H3

InChIKey

QRMPKOFEUHIBNM-UHFFFAOYSA-N

Smiles

C1(CCC(C)CC1)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -8.70E+01 deg C   EXP
Boiling Point 120 deg C   EXP
log P (octanol-water) 4.010 (none)   EST
Water Solubility 3.84 mg/L 25 EXP
Henry's Law Constant 0.450 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.19E-11 cm3/molecule-sec 25 EST

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