Ethyl 3-nitrocinnamate

• CAS: 5396-71-4
• Catalog Number: ACM5396714
• Category: Other Products
• Molecular Weight: 221.21
• Molecular Formula: C₁₁H₁₁NO₄
• Synonyms: 3-Nitrobenzeneacrylic acid ethyl ester
• IUPAC Name: Ethyl (E)-3-(3-nitrophenyl)prop-2-enoate
• 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
• 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