(E)-3-(4-Nitrophenyl)-1-Phenylprop-2-En-1-One
[CAS# 1222-98-6]

Identification

• Classification: Chemical reagent >> Organic reagent >> Nitro compound
• Name: (E)-3-(4-Nitrophenyl)-1-Phenylprop-2-En-1-One
• Synonyms: 3-(4-Nitrophenyl)-1-Phenylprop-2-En-1-One; (E)-3-(4-Nitrophenyl)-1-Phenyl-Prop-2-En-1-One; 3-(4-Nitrophenyl)-1-Phenyl-Prop-2-En-1-One
• Molecular Formula: C₁₅H₁₁NO₃
• Molecular Weight: 253.26
• CAS Registry Number: 1222-98-6 (2960-55-6)
• EINECS: 214-949-5
• SMILES: C2=C(C(\C=C\C1=CC=C([N+](=O)[O-])C=C1)=O)C=CC=C2
• InChI: 1S/C15H11NO3/c17-15(13-4-2-1-3-5-13)11-8-12-6-9-14(10-7-12)16(18)19/h1-11H/b11-8+
• InChIKey: WDZGGAFMGIOIQS-DHZHZOJOSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Melting point: 162-166°C (Expl.)
• Boiling point: 399.2±34.0°C at 760 mmHg (Cal.)
• Flash point: 186.5±18.5°C (Cal.)

Safety Data

• Safety Code: S26;S37
• Risk Code: R36/37/38
• Hazard Symbol: X
• Safety Description: IRRITANT