3-Bromo-2-Buten-2-Yl Phenylacetate
[CAS# 81214-87-1]

Identification

• Name: 3-Bromo-2-Buten-2-Yl Phenylacetate
• Synonyms: [(E)-2-Bromo-1-Methyl-Prop-1-Enyl] 2-Phenylacetate; 2-Phenylacetic Acid [(E)-2-Bromo-1-Methylprop-1-Enyl] Ester; 2-Phenylacetic Acid [(E)-2-Bromo-1-Methyl-Prop-1-Enyl] Ester
• Molecular Formula: C₁₂H₁₃BrO₂
• Molecular Weight: 269.14
• CAS Registry Number: 81214-87-1
• SMILES: C1=C(CC(OC(=C(Br)\C)/C)=O)C=CC=C1
• InChI: 1S/C12H13BrO2/c1-9(13)10(2)15-12(14)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3/b10-9+
• InChIKey: LNVRLHPFTFZXME-MDZDMXLPSA-N

Properties

• Density: 1.358g/cm³ (Cal.)
• Boiling point: 314.335°C at 760 mmHg (Cal.)
• Flash point: 143.905°C (Cal.)