(E)-6-(3-Nitrophenyl)-4-Oxohex-5-Enoic Acid
[CAS# 74038-57-6]

Identification

• Name: (E)-6-(3-Nitrophenyl)-4-Oxohex-5-Enoic Acid
• Synonyms: 6-(3-Nitrophenyl)-4-Oxohex-5-Enoic Acid; (E)-6-(3-Nitrophenyl)-4-Oxo-Hex-5-Enoic Acid; 6-(3-Nitrophenyl)-4-Oxo-Hex-5-Enoic Acid
• Molecular Formula: C₁₂H₁₁NO₅
• Molecular Weight: 249.22
• CAS Registry Number: 74038-57-6
• SMILES: C1=C([N+]([O-])=O)C=CC=C1\C=C\C(=O)CCC(=O)O
• InChI: 1S/C12H11NO5/c14-11(6-7-12(15)16)5-4-9-2-1-3-10(8-9)13(17)18/h1-5,8H,6-7H2,(H,15,16)/b5-4+
• InChIKey: VBUVBQVVUXMCTD-SNAWJCMRSA-N

Properties

• Density: 1.358g/cm³ (Cal.)
• Boiling point: 481.317°C at 760 mmHg (Cal.)
• Flash point: 206.587°C (Cal.)