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CAS Number: 18749-47-8
2-(3-acetylphenyl)acetic acid

Structure

2-(3-acetylphenyl)acetic acid
Name: 2-(3-acetylphenyl)acetic acid
Synonyms:
General Information
Product Number: 18749478

CAS Registry Number 18749-47-8
Name:
Benzeneacetic acid, 3-​acetyl-
Acetic acid, (m-acetylphenyl)- (8CI)

 

Chemical Formula: C10H10O3
Exact Mass: 178.06
Molecular Weight: 178.18
m/z: 178.06 (100.0%), 179.07 (11.0%), 180.07 (1.2%)

 

InChI:InChI=1S/C10H10O3/c1-7(11)9-4-2-3-8(5-9)6-10(12)13/h2-5H,6H2,1H3,(H,12,13)

InChI Key:CVAUIEAXZWBCSQ-UHFFFAOYSA-N

Canonical SMILES:CC(=O)C1=CC(=CC=C1)CC(=O)O

 

Thermal Properties Value Condition Note
Melting Point 106 °C   (2)CAS
Melting Point 96-99 °C Solv: water (7732-18-5) (1)CAS

Specification

98%

References
  1. (1) Huck, Lawrence A.; Canadian Journal of Chemistry 2004, V82(12), P1760-1768 CAPLUS
  2. (2) Papa, Domenick; Journal of the American Chemical Society 1946, V68, P2133-4 CAPLUS
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