Butanoic acid, 3-oxo-, 2,4,6-trichlorophenyl ester

CAS Registry Number®

59225-85-3
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CAS Name

Butanoic acid, 3-oxo-, 2,4,6-trichlorophenyl ester

Molecular Formula

C10H7Cl3O3

Molecular Mass

281.52

Cite this Page

Butanoic acid, 3-oxo-, 2,4,6-trichlorophenyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=59225-85-3 (retrieved 2024-09-10) (CAS RN: 59225-85-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    57 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C10H7Cl3O3/c1-5(14)2-9(15)16-10-7(12)3-6(11)4-8(10)13/h3-4H,2H2,1H3

InChIKey

InChIKey=SFXGTKMFWDFCLU-UHFFFAOYSA-N

SMILES

O(C(CC(C)=O)=O)C1=C(Cl)C=C(Cl)C=C1Cl

Canonical SMILES

O=C(OC=1C(Cl)=CC(Cl)=CC1Cl)CC(=O)C

Other Names for this Substance

  • Butanoic acid, 3-oxo-, 2,4,6-trichlorophenyl ester
  • 2,4,6-Trichlorophenyl acetoacetate
  • 2,4,6-Trichlorophenyl 3-oxobutyrate
  • (2′,4′,6′-Trichlorophenyl) 3-oxobutanoate
  • 2,4,6-Trichlorophenyl 3-oxobutanoate