1-Phenylethyl 2-Chloroacetoacetate
[CAS# 68683-30-7]

Identification

• Name: 1-Phenylethyl 2-Chloroacetoacetate
• Synonyms: 1-Phenylethyl 2-Chloro-3-Oxo-Butanoate; 2-Chloro-3-Oxobutanoic Acid 1-Phenylethyl Ester; 2-Chloro-3-Keto-Butyric Acid 1-Phenylethyl Ester
• Molecular Formula: C₁₂H₁₃ClO₃
• Molecular Weight: 240.69
• CAS Registry Number: 68683-30-7
• EINECS: 272-069-7
• SMILES: C1=CC=CC=C1C(OC(C(Cl)C(=O)C)=O)C
• InChI: 1S/C12H13ClO3/c1-8(14)11(13)12(15)16-9(2)10-6-4-3-5-7-10/h3-7,9,11H,1-2H3
• InChIKey: VEDDRPPPVHQCQB-UHFFFAOYSA-N

Properties

• Density: 1.195g/cm³ (Cal.)
• Boiling point: 311.6°C at 760 mmHg (Cal.)
• Flash point: 120.919°C (Cal.)