2,3,4-trifluorocinnamic acid

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Catalog Number
ACM207742856
Product Name
2,3,4-trifluorocinnamic acid
Structure
Structure
CAS
207742-85-6
Category
Heterocyclic Organic Compound
Synonyms
3-(2,3,4-Trifluorophenyl)acrylic acid
IUPAC Name
(E)-3-(2,3,4-Trifluorophenyl)prop-2-enoic acid
Molecular Weight
202.13
Molecular Formula
C9H5F3O2
Canonical SMILES
C1=CC(=C(C(=C1C=CC(=O)O)F)F)F
InChI
InChI=1S/C9H5F3O2/c10-6-3-1-5(2-4-7(13)14)8(11)9(6)12/h1-4H,(H,13,14)/b4-2+
InChI Key
AYDLBRHSHLRVAH-DUXPYHPUSA-N
Boiling Point
273.8±35.0 °C
Melting Point
175-178 °C
Flash Point
119.4ºC
Density
1.468±0.06 g/cm³
Exact Mass
202.02416388
Hazard Statements
Xi
H-Bond Acceptor
5
H-Bond Donor
1
Isomeric SMILES
C1=CC(=C(C(=C1/C=C/C(=O)O)F)F)F
Monoisotopic Mass
202.02416388
Safety Description
26-37/39
Storage Conditions
Dry place,Room Temperature
Topological Polar Surface Area
37.3 Ų
WGK Germany
3
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