3,4-dichlorocinnamic acid

Catalog	ACM1202397
CAS	1202-39-7
Structure
Synonyms	3-(3,4-Dichlorophenyl)-2-propenoicacid
IUPAC Name	(E)-3-(3,4-Dichlorophenyl)prop-2-enoic acid
Molecular Weight	217.05
Molecular Formula	C9H6Cl2O2
Canonical SMILES	C1=CC(=C(C=C1C=CC(=O)O)Cl)Cl
InChI	InChI=1S/C9H6Cl2O2/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5H,(H,12,13)/b4-2+
InChI Key	RRLUFPHCTSFKNR-DUXPYHPUSA-N
Boiling Point	366.6±32.0 °C
Melting Point	218-220 °C
Purity	95%+
Density	1.457±0.06 g/cm³
Exact Mass	215.9744848
Isomeric SMILES	C1=CC(=C(C=C1/C=C/C(=O)O)Cl)Cl
Monoisotopic Mass	215.9744848
Physical State	Crystalline powder
Storage Conditions	Dry place,Room Temperature
Topological Polar Surface Area	37.3 Ų