2-Formylcinnamic acid

CAS	130036-17-8
Structure
Synonyms	3-Phenyl-2-propenoic acid formyl ester
IUPAC Name	(E)-3-(2-Formylphenyl)prop-2-enoic acid
Molecular Weight	176.17
Canonical SMILES	C1=CC=C(C(=C1)C=CC(=O)O)C=O
InChI	InChI=1S/C10H8O3/c11-7-9-4-2-1-3-8(9)5-6-10(12)13/h1-7H,(H,12,13)/b6-5+
InChI Key	ZIUMNQBNEUJSSL-AATRIKPKSA-N
Melting Point	57-59 °C
Purity	95%+
Exact Mass	176.047344113
Isomeric SMILES	C1=CC=C(C(=C1)/C=C/C(=O)O)C=O
Monoisotopic Mass	176.047344113
Storage Conditions	Inert atmosphere,2-8 °C
Topological Polar Surface Area	54.4 Ų