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42163

Acetophenone

analytical standard

Synonym(s):

Methyl phenyl ketone

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About This Item

Linear Formula:
CH3COC6H5
CAS Number:
98-86-2
Molecular Weight:
120.15
UNSPSC Code:
41116107
NACRES:
NA.24
PubChem Substance ID:
329756199
EC Number:
202-708-7
Beilstein/REAXYS Number:
605842
MDL number:
MFCD00008724
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grade

analytical standard

Quality Level

100

vapor density

4.1 (vs air)

vapor pressure

0.45 mmHg ( 25 °C), 1 mmHg ( 15 °C)

assay

≥99.5% (GC)

autoignition temp.

1058 °F

shelf life

limited shelf life, expiry date on the label

technique(s)

HPLC: suitable, gas chromatography (GC): suitable

refractive index

n20/D 1.534 (lit.), n20/D 1.535

bp

202 °C (lit.)

mp

19-20 °C (lit.)

density

1.03 g/mL at 25 °C (lit.)

application(s)

cleaning products
cosmetics
environmental
flavors and fragrances
food and beverages
personal care

format

neat

SMILES string

CC(=O)c1ccccc1

InChI

1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3

InChI key

KWOLFJPFCHCOCG-UHFFFAOYSA-N

General description

Acetophenone is a colourless liquid with a sweet pungent taste. It can be used in perfume industry, as a fragrance ingredient and also as a flavouring agent in food industries.

Application

Acetophenone can stimulate the reductive alkylation of aniline to form N-phenyl-alpha-methylbenzylamine. It can also undergo coupling reaction, catalyzed the copper under molecular oxygen in the presence of boron trifluoride etherate as an additive, to give 1-(4-aminophenyl)-2-phenylethane-1,2-dione.
Acetophenone may be used as an analytical reference standard for the determination of the analyte in perfumes and different varieties of African star apple fruit (Chrysophillum albidum) by chromatography techniques.
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

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pictograms

Exclamation mark
GHS07

signalword

Warning

hcodes

H302,H319

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2

Storage Class

10 - Combustible liquids

wgk

WGK 1

flash_point_f

179.6 °F - closed cup

flash_point_c

82 °C - closed cup

ppe

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

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Certificates of Analysis (COA)

Lot/Batch Number
BCCF6169
BCCD9553
BCCC6486
BCBZ7330
BCBX5911

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Copper-catalyzed aerobic oxygenative cross dehydrogenative coupling of methyl ketones with para-C?H of primary anilines
Ji X, et al.
Green Chemistry, 19, 619-622 (2017)
Catalysis of Organic Reactions, 62 (1994)
Hazardous Chemicals: Safety Management and Global Regulations (2013)
View All Related Papers

Global Trade Item Number

SKUGTIN
42163-1ML-F04061832093963
42163-5ML-F04061832093987