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253839 Sigma-Aldrich

3-Acetylbenzoic acid

98%

  • CAS Number 586-42-5

  • Linear Formula CH3COC6H4CO2H

  • Molecular Weight 164.16

  •  MDL number MFCD00045847

  •  PubChem Substance ID 24855333

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C9, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis,
Quality Level   100
assay   98%
mp   169-171 °C (lit.)
SMILES string   CC(=O)c1cccc(c1)C(O)=O
InChI   1S/C9H8O3/c1-6(10)7-3-2-4-8(5-7)9(11)12/h2-5H,1H3,(H,11,12)
InChI key   CHZPJUSFUDUEMZ-UHFFFAOYSA-N

Description

Application

3-Acetylbenzoic acid has been used in preparation of 3-(2-hydroxyethyl)benzyl alcohol and methyl 3-acetylbenzoate.

Packaging

1, 5 g in glass bottle

Safety & Documentation

Safety Information

Personal Protective Equipment 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable

Documents

Certificate of Analysis (COA)

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Protocols & Articles
Peer-Reviewed Papers
15

References

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