Ethyl α-benzoyl-β-oxobenzenepropanoate

CAS Registry Number®

4850-82-2
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CAS Name

Ethyl α-benzoyl-β-oxobenzenepropanoate

Molecular Formula

C18H16O4

Molecular Mass

296.32

Cite this Page

Ethyl α-benzoyl-β-oxobenzenepropanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4850-82-2 (retrieved 2024-05-18) (CAS RN: 4850-82-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    194 °C @ Press: 15 Torr

  • Melting Point (2)

    97-98 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H16O4/c1-2-22-18(21)15(16(19)13-9-5-3-6-10-13)17(20)14-11-7-4-8-12-14/h3-12,15H,2H2,1H3

InChIKey

InChIKey=JHWPTSCKSATEQK-UHFFFAOYSA-N

SMILES

C(C(=O)C1=CC=CC=C1)(C(=O)C2=CC=CC=C2)C(OCC)=O

Canonical SMILES

O=C(OCC)C(C(=O)C=1C=CC=CC1)C(=O)C=2C=CC=CC2

Other Names for this Substance

  • Benzenepropanoic acid, α-benzoyl-β-oxo-, ethyl ester
  • Acetic acid, dibenzoyl-, ethyl ester
  • Ethyl α-benzoyl-β-oxobenzenepropanoate
  • Ethyl dibenzoylacetate
  • NSC 631498

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