Ethyl 5-(3-nitrophenyl)-5-oxopentanoate
[CAS# 898777-51-0]

Identification

• Name: Ethyl 5-(3-nitrophenyl)-5-oxopentanoate
• Synonyms: Ethyl 5-(3-nitrophenyl)-5-oxovalerate
• Molecular Formula: C₁₃H₁₅NO₅
• Molecular Weight: 265.26
• CAS Registry Number: 898777-51-0
• SMILES: O=[N+]([O-])c1cc(ccc1)C(=O)CCCC(=O)OCC
• InChI: 1S/C13H15NO5/c1-2-19-13(16)8-4-7-12(15)10-5-3-6-11(9-10)14(17)18/h3,5-6,9H,2,4,7-8H2,1H3
• InChIKey: PBKPVXIYNCRFRG-UHFFFAOYSA-N

Properties

• Density: 1.212g/cm³ (Cal.)
• Boiling point: 379.154°C at 760 mmHg (Cal.)
• Flash point: 156.106°C (Cal.)
• Refractive index: 1.531 (Cal.)