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Merck
CN

108367

Cyclobutyl phenyl ketone

98%

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About This Item

Linear Formula:
C6H5COC4H7
CAS Number:
Molecular Weight:
160.21
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
226-473-5
MDL number:
Assay:
98%
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Product Name

Cyclobutyl phenyl ketone, 98%

InChI key

MVEBDOSCXOQNAR-UHFFFAOYSA-N

InChI

1S/C11H12O/c12-11(10-7-4-8-10)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2

SMILES string

O=C(C1CCC1)c2ccccc2

assay

98%

refractive index

n20/D 1.547 (lit.)

bp

114-118 °C/7 mmHg (lit.)

density

1.05 g/mL at 25 °C (lit.)

functional group

ketone
phenyl

Quality Level

Application

Cyclobutyl phenyl ketone was used to study thermal reactions of parent and phenyl substituted N-acyl cyclobutylimines.

General description

Cyclobutyl phenyl ketone reacts with 2-butanol and di-t-butyl peroxide to yield valerophenone.

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves

Regulatory Information

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Some Reactions of Cyclobutylcarbinyl Radical Intermediates.
Neckers DC, et al.
The Journal of Organic Chemistry, 31(2), 622-624 (1966)
Thermal Reactions of N-Acyl Phenylcyclobutylimines.
Wu PL.
J. Chin. Chem. Soc., 45, 183-188 (1998)
Jose Serrano et al.
Xenobiotica; the fate of foreign compounds in biological systems, 50(2), 192-208 (2019-03-20)
1. Cyclic phenones are chemicals of interest to the USEPA due to their potential for endocrine disruption to aquatic and terrestrial species.2. Prior to this report, there was very limited information addressing metabolism of cyclic phenones by fish species and

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