Benzyl acetoacetate
CAS Registry Number®
5396-89-4
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CAS Name
Benzyl acetoacetateMolecular Formula
C11H12O3Molecular Mass
192.21Cite this Page
Benzyl acetoacetate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5396-89-4 (retrieved ) (CAS RN: 5396-89-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
97 °C @ Press: 12 Torr
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C11H12O3/c1-9(12)7-11(13)14-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
InChIKey
InChIKey=WOFAGNLBCJWEOE-UHFFFAOYSA-N
SMILES
C(OC(CC(C)=O)=O)C1=CC=CC=C1
Canonical SMILES
O=C(OCC=1C=CC=CC1)CC(=O)C
Other Names for this Substance
- Butanoic acid, 3-oxo-, phenylmethyl ester
- Acetoacetic acid, benzyl ester
- Benzyl acetoacetate
- Benzyl acetylacetate
- Benzyl 3-oxobutanoate
Deleted or Replaced CAS Registry Numbers
1629358-35-5
