Butanoic acid, 3-oxo-, 2-chloroethyl ester

CAS Registry Number®

54527-68-3
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CAS Name

Butanoic acid, 3-oxo-, 2-chloroethyl ester

Molecular Formula

C6H9ClO3

Molecular Mass

164.59

Cite this Page

Butanoic acid, 3-oxo-, 2-chloroethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=54527-68-3 (retrieved 2024-09-19) (CAS RN: 54527-68-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    198 °C

  • Density (2)

    1.2055 g/cm³ @ Temp: 21 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H9ClO3/c1-5(8)4-6(9)10-3-2-7/h2-4H2,1H3

InChIKey

InChIKey=JAEUQHNZRROYID-UHFFFAOYSA-N

SMILES

C(C(OCCCl)=O)C(C)=O

Canonical SMILES

O=C(OCCCl)CC(=O)C

Other Names for this Substance

  • Butanoic acid, 3-oxo-, 2-chloroethyl ester
  • Acetoacetic acid, 2-chloroethyl ester
  • 2-Chloroethyl acetoacetate
  • β-Chloroethyl acetoacetate
  • 2-Chloroethyl 3-oxobutanoate