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130362

Sigma-Aldrich

Isobutyrophenone

97%

Synonym(s):

2-Methyl-1-phenyl-1-propanone, Isobutyrylbenzene

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About This Item

Linear Formula:
C6H5COCH(CH3)2
CAS Number:
Molecular Weight:
148.20
Beilstein/REAXYS Number:
774499
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

vapor pressure

1 mmHg ( 50 °C)

assay

97%

form

liquid

refractive index

n20/D 1.517 (lit.)

bp

217 °C (lit.)

density

0.988 g/mL at 25 °C (lit.)

SMILES string

CC(C)C(=O)c1ccccc1

InChI

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

InChI key

BSMGLVDZZMBWQB-UHFFFAOYSA-N

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Application

Isobutyrophenone was used as an internal standard in the determination of hydroxyzine hydrochloride and benzyl alcohol in injection solutions. It was also used in the preparation of alpha-hydroxyisobutyrophenone.

pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

10 - Combustible liquids

wgk_germany

WGK 3

flash_point_f

183.2 °F

flash_point_c

84 °C

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter


Certificates of Analysis (COA)

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G N Menon et al.
Journal of pharmaceutical sciences, 70(6), 697-698 (1981-06-01)
A stability-indicating, high-performance liquid chromatographic method was developed for the simultaneous determination of hydroxyzine hydrochloride and benzyl alcohol in injection solutions. Separation was achieved using a mu Bondapak C18 column and the eluent [60% water, 25% acetonitrile, and 15% methanol

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