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Key Documents

P22303

Sigma-Aldrich

1-Phenyl-1-cyclohexene

95%

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About This Item

Linear Formula:
C6H5C6H9
CAS Number:
Molecular Weight:
158.24
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

95%

refractive index

n20/D 1.57 (lit.)

bp

251-253 °C (lit.)

mp

−11 °C (lit.)

density

0.994 g/mL at 25 °C (lit.)

SMILES string

C1CCC(=CC1)c2ccccc2

InChI

1S/C12H14/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7-9H,2,5-6,10H2

InChI key

WCMSFBRREKZZFL-UHFFFAOYSA-N

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

217.4 °F - closed cup

Flash Point(C)

103.00 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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C E Cook et al.
Drug metabolism and disposition: the biological fate of chemicals, 12(2), 186-192 (1984-03-01)
In vitro metabolites of 1-phenylcyclohexene produced by the 10,000g supernatant fraction from rat liver homogenates were identified by a combination of spectrometric, chromatographic, and synthetic techniques. Initial oxidation occurred in the 3-position of 1-phenylcyclohexene to yield 1-phenyl-1-cyclohexen-3-one and 1-phenyl-1-cyclohexen-3-ol. Further
A S Freeman et al.
Drug metabolism and disposition: the biological fate of chemicals, 10(6), 680-684 (1982-11-01)
Mice were exposed to the smoke from placebo marihuana cigarettes treated with phencyclidine hydrochloride (PCP . HCl). A dose-related decrement in motor performance was observed after exposure to the smoke from cigarettes containing 10-15 mg of PCP . HCl. Tissue
F C Law et al.
Drug and chemical toxicology, 7(3), 273-282 (1984-01-01)
The biliary excretion of 14C-phenylcyclohexene and its metabolites were studied in rats pretreated with an inducer or inhibitor of mixed-function oxidases or with an agent known to deplete liver glutathione. Pretreatment of rats with 3-methylcholanthrene or phenobarbital enhanced the biliary
B R Martin et al.
Drug metabolism and disposition: the biological fate of chemicals, 10(6), 685-689 (1982-11-01)
The in vitro metabolism of 1-3H-phenyl-1-cyclohexene (3H-PC) was studied in a crude microsomal preparation from mouse livers. The major routes of metabolism were allylic hydroxylation, oxidation of the allylic alcohol, and epoxidation-hydrolysis. The following metabolites were identified by comparison with
D H Young et al.
Bioorganic & medicinal chemistry letters, 11(11), 1393-1396 (2001-05-30)
Phenylcyclohexenes (PCHs) [e.g., trans-4-nitro-5-(2,3,4-trimethoxyphenyl)cyclohexene, 2d] were found to bind weakly to the colchicine site of bovine tubulin, but are the first mimics of colchicine found to have high activity towards plant cells. Structure-activity relationships for PCHs and biphenyl AC-ring analogues

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