(3E)-4-(4-Methoxyphenyl)-3-buten-2-one
[CAS# 943-87-3]

Identification

• Name: (3E)-4-(4-Methoxyphenyl)-3-buten-2-one
• Synonyms: (E)-4-(4-Methoxy-phenyl)-but-3-en-2-one; 1-(4-Methoxyphenyl)-but-1-en-3-one; 1-(P-Methoxyphenyl)-1-buten-3-one
• Molecular Formula: C₁₁H₁₂O₂
• Molecular Weight: 176.21
• CAS Registry Number: 943-87-3
• SMILES: CC(=O)/C=C/C1=CC=C(C=C1)OC
• InChI: 1S/C11H12O2/c1-9(12)3-4-10-5-7-11(13-2)8-6-10/h3-8H,1-2H3/b4-3+
• InChIKey: WRRZKDVBPZBNJN-ONEGZZNKSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Melting point: 75-77°C (Expl.)
• Boiling point: 319.8±17.0°C at 760 mmHg (Cal.)
• Flash point: 148.3±14.5°C (Cal.)

Safety Data

• Safety Description: IRRITANT