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2-Chloro-6-fluorocinnamic acid

CAS
392-22-3
Catalog Number
ACM392223
Category
Other Products
Molecular Weight
200.59
Molecular Formula
C9H6ClFO2

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Specification

Synonyms
3-(2-Chloro-6-fluorophenyl)-2-propenoate
IUPAC Name
(E)-3-(2-Chloro-6-fluorophenyl)prop-2-enoic acid
Canonical SMILES
C1=CC(=C(C(=C1)Cl)C=CC(=O)O)F
InChI
InChI=1S/C9H6ClFO2/c10-7-2-1-3-8(11)6(7)4-5-9(12)13/h1-5H,(H,12,13)/b5-4+
InChI Key
NDWALECYVLNBQG-SNAWJCMRSA-N
Boiling Point
312.8±27.0 °C
Melting Point
165-169 °C
Density
1.420±0.06 g/cm³
Exact Mass
200.0040353
Isomeric SMILES
C1=CC(=C(C(=C1)Cl)/C=C/C(=O)O)F
Monoisotopic Mass
200.0040353
Topological Polar Surface Area
37.3 Ų
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