4-Chloro-2-fluorocinnamic acid

Catalog	ACM202982658
CAS	202982-65-8
Structure
Synonyms	3-(4-Chloro-2-fluorophenyl)acrylic acid
IUPAC Name	(E)-3-(4-Chloro-2-fluorophenyl)prop-2-enoic acid
Molecular Weight	200.59
Molecular Formula	C9H6ClFO2
Canonical SMILES	C1=CC(=C(C=C1Cl)F)C=CC(=O)O
InChI	InChI=1S/C9H6ClFO2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1-5H,(H,12,13)/b4-2+
InChI Key	FVLPOWWRHAOKMT-DUXPYHPUSA-N
Boiling Point	316.4±27.0 °C
Melting Point	213-216 °C
Purity	95%+
Density	1.3522 g/mL at 25 °C(lit.)
Exact Mass	200.0040353
Isomeric SMILES	C1=CC(=C(C=C1Cl)F)/C=C/C(=O)O
Monoisotopic Mass	200.0040353
Storage Conditions	Dry place,Room Temperature
Topological Polar Surface Area	37.3 Ų