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CAS Number: 721-63-1
ethyl 2-(4-(trifluoromethyl)phenyl)acetate

Structure

 ethyl 2-(4-(trifluoromethyl)phenyl)acetate
Name: ethyl 2-(4-(trifluoromethyl)phenyl)acetate
Synonyms:
General Information
Product Number: 721631

CAS Registry Number 721-63-1
Name:
Benzeneacetic acid, 4-?(trifluoromethyl)?-?, ethyl ester
Acetic acid, (α,α,α-trifluoro-p-tolyl)-, ethyl ester (7CI,8CI)
Ethyl 2-[4-(trifluoromethyl)phenyl]acetate
Ethyl [4-(trifluoromethyl)phenyl]acetate
[4-(Trifluoromethyl)phenyl]acetic acid ethyl ester

 

Chemical Formula: C11H11F3O2
Exact Mass: 232.07
Molecular Weight: 232.20
m/z: 232.07 (100.0%), 233.07 (11.9%), 234.08 (1.1%)

 

InChI:InChI=1S/C11H11F3O2/c1-2-16-10(15)7-8-3-5-9(6-4-8)11(12,13)14/h3-6H,2,7H2,1H3

InChI Key:BDVKGYOFECBKDX-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)CC1=CC=C(C=C1)C(F)(F)F

 

Thermal Properties Value Condition Note
Boiling Point 104-105 °C Press: 7 Torr (1)CAS
Melting Point 37 °C   (2)CAS
Melting Point 34-35 °C   (1)CAS

Specification

98%
References
  1. (1) Rosenkrantz, Bernard E.; Journal of Chemical and Engineering Data 1963, V8(2), P237-8 CAPLUS
  2. (2) Song, Bingrui; Advanced Synthesis & Catalysis 2011, V353(9), P1565-1574 CAPLUS
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