Ethyl 2,2-dimethylacetoacetate

CAS Registry Number®

597-04-6

CAS Name

Ethyl 2,2-dimethylacetoacetate

Molecular Formula

C8H14O3

Molecular Mass

158.20

Cite this Page

Ethyl 2,2-dimethylacetoacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=597-04-6 (retrieved 2024-11-28) (CAS RN: 597-04-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    182 °C

  • Density (2)

    0.9784 g/cm³ @ Temp: 20 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
  • (2) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C8H14O3/c1-5-11-7(10)8(3,4)6(2)9/h5H2,1-4H3

InChIKey

InChIKey=NVAHZHOCRQCUBY-UHFFFAOYSA-N

SMILES

C(C(OCC)=O)(C(C)=O)(C)C

Canonical SMILES

O=C(OCC)C(C(=O)C)(C)C

Other Names for this Substance

  • Butanoic acid, 2,2-dimethyl-3-oxo-, ethyl ester
  • Acetoacetic acid, 2,2-dimethyl-, ethyl ester
  • Ethyl 2,2-dimethyl-3-oxobutyrate
  • Ethyl α,α-dimethylacetoacetate
  • Ethyl 2,2-dimethylacetoacetate

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