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Structure

Benzeneacetic acid,2-fluoro-6-(trifluoromethyl)-

CAS
179946-32-8
Catalog Number
ACM179946328
Category
Other Products
Molecular Weight
222.14
Molecular Formula
C9H6 F4 O2

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Specification

Synonyms
539643_ALDRICH, JRD-0100, 2-Fluoro-6-(trifluoromethyl)phenylacetic acid, 179946-32-8
IUPAC Name
2-[2-fluoro-6-(trifluoromethyl)phenyl]acetic acid
Canonical SMILES
C1=CC(=C(C(=C1)F)CC(=O)O)C(F)(F)F
InChI Key
ZVXIGDPHHXXMMF-UHFFFAOYSA-N
Boiling Point
243ºC at 760mmHg
Melting Point
86-89ºC(lit.)
Flash Point
100.8ºC
Density
1.436g/cm³
Exact Mass
222.03000
Hazard Statements
Xn: Harmful;Xi: Irritant;
H-Bond Acceptor
6
H-Bond Donor
1
Safety Description
36
WGK Germany
3
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