40000
trans-1,4-Dimethylcyclohexane
≥98.0% (GC)
Synonym(s):
trans-Hexahydro-p-xylene
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About This Item
Empirical Formula (Hill Notation):
C8H16
CAS Number:
Molecular Weight:
112.21
EC Number:
218-622-8
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
1900344
MDL number:
Assay:
≥98.0% (GC)
Form:
liquid
InChI key
QRMPKOFEUHIBNM-ZKCHVHJHSA-N
InChI
1S/C8H16/c1-7-3-5-8(2)6-4-7/h7-8H,3-6H2,1-2H3/t7-,8-
SMILES string
C[C@H]1CC[C@H](C)CC1
assay
≥98.0% (GC)
form
liquid
refractive index
n20/D 1.421
bp
117-119 °C
solubility
water: soluble
density
0.761 g/mL at 20 °C (lit.)
General description
trans-1,4-Dimethylcyclohexane is a branched cyclohexane (C6) compound. Rate coefficients for the reaction of Cl atoms and OH radicals with trans-1,4-dimethylcyclohexane has been evaluated by Fourier transform infrared (FTIR) spectroscopy and gas chromatography-mass spectrometry (GC-MS). Oxidation of trans-1,4-dimethylcyclohexane with H2O2 catalyzed by hexafluorophosphate salt and carboxylic acid has been reported. Crystal structure of trans-1,4-Dimethylcyclohexane has been studied.
Application
trans-1,4-Dimethylcyclohexane (trans-Hexahydro-p-xylene) has been used to evaluate its solid-liquid phase transitions upto pressures of 300MPa and temperatures of 293K. Experimental data for the transition has been represented by Simon equation and 2nd order polynomial equation.
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Flam. Liq. 2
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
42.8 °F - closed cup
flash_point_c
6 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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