295892

Benzyl acetoacetate

97%

• Synonym(s): Acetoacetic acid benzyl ester
• Linear Formula: CH₃COCH₂COOCH₂C₆H₅
• CAS Number: 5396-89-4
• Molecular Weight: 192.21
• Beilstein/REAXYS Number: 2049615
• EC Number: 226-416-4
• MDL number: MFCD00008785
• UNSPSC Code: 12352100
• PubChem Substance ID: 24857819
• NACRES: NA.22

Properties

• assay: 97%
• refractive index: n20/D 1.512 (lit.)
• bp: 156-159 °C/10 mmHg (lit.)
• density: 1.112 g/mL at 25 °C (lit.)
• SMILES string: CC(=O)CC(=O)OCc1ccccc1
• InChI: 1S/C11H12O3/c1-9(12)7-11(13)14-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
• InChI key: WOFAGNLBCJWEOE-UHFFFAOYSA-N

Safety Information

• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 1
• flash_point_f: 235.4 °F - closed cup
• flash_point_c: 113 °C - closed cup
• ppe: Eyeshields, Gloves