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2-Benzoylacetoacetic Acid Ethyl Ester
[CAS# 569-37-9]

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Identification
Name 2-Benzoylacetoacetic Acid Ethyl Ester
Synonyms Ethyl 2-(Benzoyl)-3-Oxo-Butanoate; 3-Oxo-2-(Oxo-Phenylmethyl)Butanoic Acid Ethyl Ester; 2-(Benzoyl)-3-Keto-Butyric Acid Ethyl Ester
Molecular Structure CAS#: 569-37-9, 2-Benzoylacetoacetic Acid Ethyl Ester
Molecular Formula C13H14O4
Molecular Weight 234.25
CAS Registry Number 569-37-9
EINECS 209-313-9
SMILES C1=C(C(=O)C(C(OCC)=O)C(=O)C)C=CC=C1
InChI 1S/C13H14O4/c1-3-17-13(16)11(9(2)14)12(15)10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3
InChIKey CMJWTVYVMCEPGG-UHFFFAOYSA-N
Properties
Density 1.146g/cm3 (Cal.)
Boiling point 325.302°C at 760 mmHg (Cal.)
Flash point 141.091°C (Cal.)
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