Ethyl 2-[(4-chlorophenyl)methylene]-3-oxobutanoate

CAS Registry Number®

19411-80-4
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CAS Name

Ethyl 2-[(4-chlorophenyl)methylene]-3-oxobutanoate

Molecular Formula

C13H13ClO3

Molecular Mass

252.69

Cite this Page

Ethyl 2-[(4-chlorophenyl)methylene]-3-oxobutanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19411-80-4 (retrieved 2024-09-09) (CAS RN: 19411-80-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    87 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H13ClO3/c1-3-17-13(16)12(9(2)15)8-10-4-6-11(14)7-5-10/h4-8H,3H2,1-2H3

InChIKey

InChIKey=SGLZOEHATVEHGH-UHFFFAOYSA-N

SMILES

C(=CC1=CC=C(Cl)C=C1)(C(OCC)=O)C(C)=O

Canonical SMILES

O=C(OCC)C(=CC1=CC=C(Cl)C=C1)C(=O)C

Other Names for this Substance

  • Butanoic acid, 2-[(4-chlorophenyl)methylene]-3-oxo-, ethyl ester
  • Cinnamic acid, α-acetyl-p-chloro-, ethyl ester
  • Ethyl 2-[(4-chlorophenyl)methylene]-3-oxobutanoate
  • Ethyl 2-(4-chlorobenzylidene)acetoacetate
  • NSC 637296

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Deleted or Replaced CAS Registry Numbers

2616746-86-0