3-(4-Methoxyphenyl)-1-(4-Nitrophenyl)Prop-2-En-1-One
[CAS# 6552-62-1]

Identification

• Name: 3-(4-Methoxyphenyl)-1-(4-Nitrophenyl)Prop-2-En-1-One
• Synonyms: 3-(4-Methoxyphenyl)-1-(4-Nitrophenyl)Prop-2-En-1-One; Aids046025; Bim-0023759.P001
• Molecular Formula: C₁₆H₁₃NO₄
• Molecular Weight: 283.28
• CAS Registry Number: 6552-62-1
• SMILES: C1=C(C=CC(=C1)[N+](=O)[O-])C(\C=C\C2=CC=C(C=C2)OC)=O
• InChI: 1S/C16H13NO4/c1-21-15-9-2-12(3-10-15)4-11-16(18)13-5-7-14(8-6-13)17(19)20/h2-11H,1H3/b11-4+
• InChIKey: OEFOVQFJRDIUTL-NYYWCZLTSA-N

Properties

• Density: 1.255g/cm³ (Cal.)
• Boiling point: 486.935°C at 760 mmHg (Cal.)
• Flash point: 216.169°C (Cal.)

References

• (1): P. S. Patil, J. B.-J. Teh, H.-K. Fun, I. A. Razak and S. M. Dharmaprakash. 3-(4-Methoxyphenyl)-1-(4-nitrophenyl)prop-2-en-1-one, Acta Cryst. (2006). E62, o896-o898