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Structure

Benzoic acid,3-chloro-2-fluoro-6-(trifluoromethyl)-

CAS
186517-41-9
Catalog Number
ACM186517419
Category
Other Products
Molecular Weight
242.55
Molecular Formula
C8H3ClF4O2

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Specification

Synonyms
JRD-1021, ST5407342, 3-Chloro-2-fluoro-6-(trifluoromethyl)benzoic acid, 186517-41-9
IUPAC Name
3-chloro-2-fluoro-6-(trifluoromethyl)benzoic acid
Canonical SMILES
C1=CC(=C(C(=C1C(F)(F)F)C(=O)O)F)Cl
InChI Key
PCNHWBAPTNAREE-UHFFFAOYSA-N
Boiling Point
263.2ºC at 760mmHg
Melting Point
96-98ºC
Flash Point
113ºC
Density
1.599g/cm³
Exact Mass
241.97600
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
6
H-Bond Donor
1
Safety Description
S26-S36
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