4-Nitrocinnamic acid

CAS	619-89-6
Structure
Synonyms	(2E)-3-(4-Nitrophenyl)prop-2-enoic acid
IUPAC Name	(E)-3-(4-Nitrophenyl)prop-2-enoic acid
Molecular Weight	193.16
Canonical SMILES	C1=CC(=CC=C1C=CC(=O)O)[N+](=O)[O-]
InChI	InChI=1S/C9H7NO4/c11-9(12)6-3-7-1-4-8(5-2-7)10(13)14/h1-6H,(H,11,12)/b6-3+
InChI Key	XMMRNCHTDONGRJ-ZZXKWVIFSA-N
Boiling Point	329.36 °C
Melting Point	200-202 °C
Purity	98%+
Density	1.4058 g/mL at 25 °C(lit.)
Exact Mass	193.0375077
Isomeric SMILES	C1=CC(=CC=C1/C=C/C(=O)O)[N+](=O)[O-]
Monoisotopic Mass	193.0375077
Physical State	Powder
Refractive Index	n20/D 1.52(lit.)
Storage Conditions	Dry place,under -20 °C
Topological Polar Surface Area	83.1 Ų