Nitrofarin
[CAS# 17298-36-1]

Identification

• Name: Nitrofarin
• Synonyms: 2-Hydroxy-3-[1-(4-Nitrophenyl)-3-Oxo-Pentyl]Chromen-4-One; 2-Hydroxy-3-[1-(4-Nitrophenyl)-3-Oxopentyl]-4-Chromenone; 2-Hydroxy-3-[3-Keto-1-(4-Nitrophenyl)Pentyl]Chromone
• Molecular Formula: C₂₀H₁₇NO₆
• Molecular Weight: 367.36
• CAS Registry Number: 17298-36-1
• SMILES: C3=C(C(CC(=O)CC)C2=C(OC1=CC=CC=C1C2=O)O)C=CC(=C3)[N+]([O-])=O
• InChI: 1S/C20H17NO6/c1-2-14(22)11-16(12-7-9-13(10-8-12)21(25)26)18-19(23)15-5-3-4-6-17(15)27-20(18)24/h3-10,16,24H,2,11H2,1H3
• InChIKey: MKMNPHPDTRVODA-UHFFFAOYSA-N

Properties

• Density: 1.391g/cm³ (Cal.)
• Boiling point: 554.506°C at 760 mmHg (Cal.)
• Flash point: 289.155°C (Cal.)