3,5-Difluorocinnamic acid

CAS	147700-58-1
Structure
Synonyms	Trans-3,5-difluorocinnamic acid
IUPAC Name	(E)-3-(3,5-Difluorophenyl)prop-2-enoic acid
Molecular Weight	184.14
Canonical SMILES	C1=C(C=C(C=C1F)F)C=CC(=O)O
InChI	InChI=1S/C9H6F2O2/c10-7-3-6(1-2-9(12)13)4-8(11)5-7/h1-5H,(H,12,13)/b2-1+
InChI Key	MBAWRXICVNIUGY-OWOJBTEDSA-N
Boiling Point	272.0±25.0 °C
Melting Point	204-205 °C
Purity	95%+
Density	1.379±0.06 g/cm³
Exact Mass	184.03358575
Isomeric SMILES	C1=C(C=C(C=C1F)F)/C=C/C(=O)O
Monoisotopic Mass	184.03358575
Topological Polar Surface Area	37.3 Ų