2,3-Dichlorocinnamic acid

Catalog	ACM20595442
CAS	20595-44-2
Structure
Synonyms	(E)-3-(2,3-Dichlorophenyl)-2-propenoic acid
IUPAC Name	(E)-3-(2,3-Dichlorophenyl)prop-2-enoic acid
Molecular Weight	217.05
Molecular Formula	C9H6Cl2O2
Canonical SMILES	C1=CC(=C(C(=C1)Cl)Cl)C=CC(=O)O
InChI	InChI=1S/C9H6Cl2O2/c10-7-3-1-2-6(9(7)11)4-5-8(12)13/h1-5H,(H,12,13)/b5-4+
InChI Key	RCEWIEGWGDHVNK-SNAWJCMRSA-N
Boiling Point	363.0±32.0 °C
Melting Point	229-234 °C
Purity	95%+
Density	1.457 g/mL at 25 °C(lit.)
Exact Mass	215.9744848
Isomeric SMILES	C1=CC(=C(C(=C1)Cl)Cl)/C=C/C(=O)O
Monoisotopic Mass	215.9744848
Storage Conditions	2-8 °C
Topological Polar Surface Area	37.3 Ų