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Merck

177458

4-Acetylbenzoic acid

98%

Synonym(s):

Acetophenone-4-carboxylic acid

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About This Item

Linear Formula:
CH3COC6H4CO2H
CAS Number:
Molecular Weight:
164.16
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
209-588-5
Beilstein/REAXYS Number:
2207355
MDL number:
Assay:
98%
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Quality Segment

assay

98%

mp

208-210 °C (lit.)

functional group

carboxylic acid, ketone

SMILES string

CC(=O)c1ccc(cc1)C(O)=O

InChI

1S/C9H8O3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3,(H,11,12)

InChI key

QBHDSQZASIBAAI-UHFFFAOYSA-N

Application

4-Acetylbenzoic acid was used in the preparation of an ester-derivative of paclitaxel.


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Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)



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