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CAS Number: 589-06-0
4-(4-fluorophenyl)butanoic acid

Structure

 4-(4-fluorophenyl)butanoic acid
Name: 4-(4-fluorophenyl)butanoic acid
Synonyms:
General Information
Product Number: 589060

CAS Registry Number 589-06-0
Name:
Benzenebutanoic acid, 4-?fluoro-
Butyric acid, 4-(p-fluorophenyl)- (6CI,7CI,8CI)
4-(4-Fluorophenyl)butanoic acid
4-(4-Fluorophenyl)butyric acid
4-(p-Fluorophenyl)butyric acid
4-Fluorobenzenebutanoic acid

 

Chemical Formula: C10H11FO2
Exact Mass: 182.07
Molecular Weight: 182.19
m/z: 182.07 (100.0%), 183.08 (11.0%)

 

InChI:InChI=1S/C10H11FO2/c11-9-6-4-8(5-7-9)2-1-3-10(12)13/h4-7H,1-3H2,(H,12,13)

InChI Key:XVQYBBYOYJXQBF-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=CC=C1CCCC(=O)O)F

 

Thermal Properties Value Condition Note
Boiling Point 161-164 °C Press: 4 Torr (1)CAS
Melting Point 38.5-39.5 °C   (2)CAS
Melting Point 30 °C (approx)   (1)CAS

Specification

98%
References
  1. (1) Fieser, Louis F.; Journal of the American Chemical Society 1948, V70, P3197-203 CAPLUS
  2. (2) Newman, Melvin S.; Journal of Organic Chemistry 1961, V26, P2667-9 CAPLUS
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