Butanoic acid, 2-acetyl-3-oxo-, ethyl ester

CAS Registry Number®

603-69-0

CAS Name

Butanoic acid, 2-acetyl-3-oxo-, ethyl ester

Molecular Formula

C8H12O4

Molecular Mass

172.18

Cite this Page

Butanoic acid, 2-acetyl-3-oxo-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=603-69-0 (retrieved 2024-11-21) (CAS RN: 603-69-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    210 °C

  • Density (2)

    1.1045 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H12O4/c1-4-12-8(11)7(5(2)9)6(3)10/h7H,4H2,1-3H3

InChIKey

InChIKey=YMCDYRGMTRCAPZ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Butanoic acid, 2-acetyl-3-oxo-, ethyl ester
  • Acetoacetic acid, 2-acetyl-, ethyl ester
  • Ethyl diacetylacetate
  • Ethyl 2-acetylacetoacetate
  • Ethyl 2-acetyl-3-oxobutyrate

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