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137227

Sigma-Aldrich

1-Phenyl-2-butanone

98%

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Synonym(s):
Benzyl ethyl ketone
Linear Formula:
C6H5CH2COC2H5
CAS Number:
Molecular Weight:
148.20
Beilstein:
1100022
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

98%

form

liquid

refractive index

n20/D 1.512 (lit.)

bp

109-112 °C/15 mmHg (lit.)

density

0.998 g/mL at 25 °C (lit.)

SMILES string

CCC(=O)Cc1ccccc1

InChI

1S/C10H12O/c1-2-10(11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3

InChI key

GKDLTXYXODKDEA-UHFFFAOYSA-N

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Application

1-Phenyl-2-butanone was used in the preparation of 1-bromo-1-phenyl-2-butanone. It was used as solute to evaluate the hydroxyl group-solvent and carbonyl group-solvent specific interactions in acetonitrile/water mixtures using the alltima C18 stationary phase by HPLC.

WGK

WGK 3

Flash Point(F)

closed cup

Flash Point(C)

closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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The hydroxyl group-solvent and carbonyl group-solvent specific interactions for some selected solutes including positional isomers in acetonitrile/water mixed solvents monitored by HPLC.
Cheong WJ, et al.
Bull. Korean Chem. Soc., 23(1), 65-70 (2002)
A rapid radiometric assay for mammalian cytosolic epoxide hydrolase.
C A Mullin et al.
Analytical biochemistry, 106(2), 476-485 (1980-08-01)
Charles W Schindler et al.
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