alpha-Vinylbenzyl Acetate
[CAS 7217-71-2]

Identification

• Name: alpha-Vinylbenzyl Acetate
• Synonyms: Acetic Acid 1-Phenylprop-2-Enyl Ester; 1-Phenylprop-2-Enyl Ethanoate; St5446655
• Molecular Formula: C₁₁H₁₂O₂
• Molecular Weight: 176.21
• CAS Registry Number: 7217-71-2
• EINECS: 230-606-2
• SMILES: C1=C(C(OC(C)=O)C=C)C=CC=C1
• InChI: 1S/C11H12O2/c1-3-11(13-9(2)12)10-7-5-4-6-8-10/h3-8,11H,1H2,2H3
• InChIKey: WAUKBOOEPYNAGU-UHFFFAOYSA-N

Properties

• Density: 1.03g/cm³ (Cal.)
• Boiling point: 242.408°C at 760 mmHg (Cal.)
• Flash point: 103.792°C (Cal.)

References

• (1): Kawatsura Motoi. Retention of regiochemistry of monosubstituted allyl acetates in the ruthenium catalysed allylic alkylation with malonate anion, Chemical Communications, 2007