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Substance Name: 1,4-Dimethylcyclohexane, trans-
RN: 2207-04-7
UNII: 8NUV3O4B1R
InChIKey: QRMPKOFEUHIBNM-ZKCHVHJHSA-N

Molecular Formula

  • C8-H16

Molecular Weight

  • 112.214
 
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Names and Synonyms

Name of Substance

  • 1,4-Dimethylcyclohexane, trans-

Synonyms

  • 1,4-Dimethylcyclohexane (trans)
  • 1,4-Dimethylcyclohexane, trans-
  • EINECS 218-622-8
  • NSC 74162
  • UNII-8NUV3O4B1R

Systematic Names

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

Superlist Names

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

Registry Numbers

CAS Registry Number

  • 2207-04-7

FDA UNII

  • 8NUV3O4B1R

System Generated Number

  • 0002207047

Structure Descriptors

InChI

1S/C8H16/c1-7-3-5-8(2)6-4-7/h7-8H,3-6H2,1-2H3/t7-,8-

InChIKey

QRMPKOFEUHIBNM-ZKCHVHJHSA-N

Smiles

C1[C@@H](CC[C@H](C1)C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -3.69E+01 deg C   EXP
Boiling Point 119.4 deg C   EXP
log P (octanol-water) 4.010 (none)   EST
Water Solubility 3.84 mg/L 25 EXP
Vapor Pressure 22.7 mm Hg 25 EXP
Henry's Law Constant 0.873 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.