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Dokumente

158011

Sigma-Aldrich

Cyclopropylbenzol

97%

Synonym(e):

Phenylcyclopropan

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About This Item

Lineare Formel:
C6H5C3H5
CAS-Nummer:
873-49-4
Molekulargewicht:
118.18
EG-Nummer:
212-839-1
MDL-Nummer:
MFCD00001275
UNSPSC-Code:
12352100
PubChem Substanz-ID:
24849715
NACRES:
NA.22

Assay

97%

Form

liquid

Brechungsindex

n20/D 1.533 (lit.)

bp

173.6 °C/753 mmHg (lit.)

Dichte

0.94 g/mL at 25 °C (lit.)

SMILES String

C1CC1c2ccccc2

InChI

1S/C9H10/c1-2-4-8(5-3-1)9-6-7-9/h1-5,9H,6-7H2

InChIKey

VFSFCYAQBIPUSL-UHFFFAOYSA-N

Verwandte Kategorien

Allgemeine Beschreibung

Cyclopropylbenzene is a cyclopropylarene and its oxidation by rabbit liver microsomal cytochrome P-450 has been studied. Gas-phase structure of cyclopropylbenzene has been studied by ab initio computational, microwave spectroscopic and electron diffraction techniques.

Piktogramme

Flame
GHS02

Signalwort

Warning

H-Sätze

H226

Gefahreneinstufungen

Flam. Liq. 3

Lagerklassenschlüssel

3 - Flammable liquids

WGK

WGK 3

Flammpunkt (°F)

111.2 °F - closed cup

Flammpunkt (°C)

44 °C - closed cup

Persönliche Schutzausrüstung

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Analysenzertifikate (COA)

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The oxidation of cyclopropyl benzene by rat liver microsomal cytochrome P-450: an unusual triple oxidation of a substrate.
K E Suckling et al.
FEBS letters, 145(2), 179-181 (1982-08-23)
C J Suckling et al.
The Biochemical journal, 232(1), 199-203 (1985-11-15)
The arylcyclopropanes (cyclopropylarenes) cyclopropylbenzene and diphenylcyclopropane are oxidized by rabbit liver microsomal cytochrome P-450, both by the microsomal fraction and by the purified cytochrome in a reconstituted system. The products formed, principally benzoic acid, are due to an unusual triple
P Riley et al.
Xenobiotica; the fate of foreign compounds in biological systems, 24(1), 1-16 (1994-01-01)
1. The metabolism of cyclopropylbenzene (1a) and 4-cyclopropylanisole (1b) was studied using liver microsomal preparations from control, phenobarbital- and beta-naphthoflavone treated rats. 2. With all three types of microsomes 1a was metabolized by benzylic hydroxylation to give 1-phenylcyclopropanol and by
Q Shen et al.
The Journal of organic chemistry, 66(17), 5840-5845 (2001-08-21)
Ab initio computational, microwave spectroscopic, and electron diffraction techniques have been used to study the gas-phase structure of cyclopropylbenzene. Theoretical calculations at the HF, B3LYP, and MP2 levels for basis sets 6-31G(d) and 6-311G(d) have been carried out. Both MP2
P Taavitsainen et al.
Drug metabolism and disposition: the biological fate of chemicals, 29(3), 217-222 (2001-02-22)
Currently, there are no selective, well characterized inhibitors for CYP2A6. Therefore, the effects of trans-(+/-)-2-phenylcyclopropylamine (tranylcypromine), a potent CYP2A6 inhibitor, on human liver microsomal cytochromes P450 (CYP) were studied to elucidate its selectivity. The IC50 value of tranylcypromine in coumarin

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