4-Formylcinnamic acid

CAS	23359-08-2
Structure
Synonyms	(2E)-3-(4-Formylphenyl)acrylic acid
IUPAC Name	(E)-3-(4-Formylphenyl)prop-2-enoic acid
Molecular Weight	176.17
Canonical SMILES	C1=CC(=CC=C1C=CC(=O)O)C=O
InChI	InChI=1S/C10H8O3/c11-7-9-3-1-8(2-4-9)5-6-10(12)13/h1-7H,(H,12,13)/b6-5+
InChI Key	LBOUHDMYVURTMA-AATRIKPKSA-N
Boiling Point	247.77 °C
Melting Point	251-254 °C
Purity	95%+
Density	1.1795 g/mL at 25 °C(lit.)
Exact Mass	176.047344113
Isomeric SMILES	C1=CC(=CC=C1/C=C/C(=O)O)C=O
Monoisotopic Mass	176.047344113
Physical State	Crystalline powder
Refractive Index	n20/D 1.4500(lit.)
Topological Polar Surface Area	54.4 Ų