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Merck
CN

00800

Acetophenone

≥98.0% (GC)

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:
12352100
PubChem Substance ID:
329747143
eCl@ss:
39023804
EC Number:
202-708-7
Beilstein/REAXYS Number:
605842
MDL number:
MFCD00008724

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InChI key

KWOLFJPFCHCOCG-UHFFFAOYSA-N

InChI

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

SMILES string

CC(=O)c1ccccc1

vapor density

4.1 (vs air)

vapor pressure

0.45 mmHg ( 25 °C), 1 mmHg ( 15 °C)

assay

≥98.0% (GC)

autoignition temp.

1058 °F

bp

202 °C (lit.)

mp

19-20 °C (lit.)

density

1.03 g/mL at 25 °C (lit.)

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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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Comment on "closing the loop on bond selective chemistry using tailored strong field laser pulses".
Xin Zhu et al.
The journal of physical chemistry. A, 113(17), 5264-5266 (2009-04-24)
Effects of solvent and substituents on the absorption spectra of triplet acetophenone and the acetophenone ketyl radical studied by nanosecond laser photolysis.
Lutz H, et al.
The Journal of Physical Chemistry, 77(14), 1758-1762 (1973)
Optically active nitrogen ligans: III. Enantioface-discriminating transfer hydrogenation of acetophenone catalyzed by rhodium (I) complexes with chiral 2-(2'-pyridyl) pyridines.
Botteghi C, et al.
Journal of Organometallic Chemistry, 304(1), 217-225 (1986)
Enantioselective hydrosilylation of acetophenone with rhodium/oxazolines catalysts.
Balavoine G, et al.
Tetrahedron Letters, 30(38), 5141-5144 (1989)
Ohmori N, et al.
The Journal of Physical Chemistry, 92(5), 1086-1093 (1988)
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