I21904
Isopropylcyclohexane
99%
Synonym(s):
2-Cyclohexylpropane, Hexahydrocumene
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About This Item
Linear Formula:
C6H11CH(CH3)2
CAS Number:
Molecular Weight:
126.24
Beilstein:
1900472
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
Recommended Products
vapor pressure
9.9 mmHg ( 37.7 °C)
Assay
99%
form
liquid
refractive index
n20/D 1.441 (lit.)
bp
155 °C (lit.)
density
0.802 g/mL at 25 °C (lit.)
SMILES string
CC(C)C1CCCCC1
InChI
1S/C9H18/c1-8(2)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3
InChI key
GWESVXSMPKAFAS-UHFFFAOYSA-N
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Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Asp. Tox. 1 - Flam. Liq. 3
Storage Class Code
3 - Flammable liquids
WGK
WGK 1
Flash Point(F)
95.0 °F - closed cup
Flash Point(C)
35 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Yasunori Takayama et al.
Scientific reports, 7, 43132-43132 (2017-02-23)
Interactions between calcium-activated chloride channel anoctamin 1 (ANO1) and transient receptor potential vanilloid 1 (TRPV1) enhance pain sensations in mice, suggesting that ANO1 inhibition could have analgesic effects. Here we show that menthol and the menthol analogue isopropylcyclohexane (iPr-CyH) inhibited
G M Henningsen et al.
Journal of toxicology and environmental health, 24(1), 19-25 (1988-01-01)
The metabolism of isopropylcyclohexane and associated renal pathology were evaluated in male Fischer 344 rats exposed by oral gavage. The rats experienced moderate proximal tubular damage similar to that produced by acyclic, branched-chain hydrocarbons. The urinary metabolites of isopropylcyclohexane included
Alexandra Nemkevich et al.
Physical chemistry chemical physics : PCCP, 12(45), 14916-14929 (2010-10-15)
A set of model compounds covering a range of polarity and flexibility have been simulated using GAFF, CHARMM22, OPLS and MM3 force fields to examine how well classical molecular dynamics simulations can reproduce structural and dynamic aspects of organic molecular
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