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Merck
CN

108723

Phenyl acetate

99%

Synonym(s):

Acetic acid phenyl ester

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About This Item

Linear Formula:
CH3COOC6H5
CAS Number:
Molecular Weight:
136.15
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
204-575-0
Beilstein/REAXYS Number:
636458
MDL number:
Assay:
99%
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Quality Segment

assay

99%

refractive index

n20/D 1.501 (lit.)

bp

196 °C (lit.)

density

1.073 g/mL at 25 °C (lit.)

functional group

ester, phenoxy

SMILES string

CC(=O)Oc1ccccc1

InChI

1S/C8H8O2/c1-7(9)10-8-5-3-2-4-6-8/h2-6H,1H3

InChI key

IPBVNPXQWQGGJP-UHFFFAOYSA-N

Gene Information

human ... PON1(5444)

General description

Phenyl acetate is an aromatic ester. Phenyl acetate levels in urine are marker for the diagnosis of some forms of unipolar major depressive disorders. It undergoes Fries rearrangement to form a mixture of o- and p-hydroxyacetophenones which are useful intermediates in manufacture of pharmaceuticals.


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pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

10 - Combustible liquids

wgk

WGK 2

flash_point_f

170.6 °F - closed cup

flash_point_c

77 °C - closed cup

ppe

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



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