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
EC Number:
211-792-4
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
1900472
MDL number:
Assay:
99%
Form:
liquid
InChI key
GWESVXSMPKAFAS-UHFFFAOYSA-N
InChI
1S/C9H18/c1-8(2)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3
SMILES string
CC(C)C1CCCCC1
vapor pressure
9.9 mmHg ( 37.7 °C)
assay
99%
form
liquid
bp
155 °C (lit.)
density
0.802 g/mL at 25 °C (lit.)
signalword
Danger
hcodes
Hazard Classifications
Asp. Tox. 1 - Flam. Liq. 3
Storage Class
3 - Flammable liquids
wgk
WGK 1
flash_point_f
95.0 °F - closed cup
flash_point_c
35 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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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