Ethyl 3-nitrocinnamate

Catalog	ACM5396714
CAS	5396-71-4
Structure
Synonyms	3-Nitrobenzeneacrylic acid ethyl ester
IUPAC Name	Ethyl (E)-3-(3-nitrophenyl)prop-2-enoate
Molecular Weight	221.21
Molecular Formula	C11H11NO4
Canonical SMILES	CCOC(=O)C=CC1=CC(=CC=C1)[N+](=O)[O-]
InChI	InChI=1S/C11H11NO4/c1-2-16-11(13)7-6-9-4-3-5-10(8-9)12(14)15/h3-8H,2H2,1H3/b7-6+
InChI Key	QZEPRSLOWNHADS-VOTSOKGWSA-N
Boiling Point	347 °C
Melting Point	74-76 °C
Flash Point	155 °C
Purity	95%+
Density	1.237 g/mL at 25 °C(lit.)
Exact Mass	221.06880783
Isomeric SMILES	CCOC(=O)/C=C/C1=CC(=CC=C1)[N+](=O)[O-]
Monoisotopic Mass	221.06880783
Storage Conditions	Dry place,Room Temperature
Topological Polar Surface Area	72.1 Ų