Pentanoic acid, 2-acetyl-4-oxo-, ethyl ester

CAS Registry Number®

41892-81-3

CAS Name

Pentanoic acid, 2-acetyl-4-oxo-, ethyl ester

Molecular Formula

C9H14O4

Molecular Mass

186.21

Cite this Page

Pentanoic acid, 2-acetyl-4-oxo-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=41892-81-3 (retrieved 2024-11-22) (CAS RN: 41892-81-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    126-128 °C @ Press: 14 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H14O4/c1-4-13-9(12)8(7(3)11)5-6(2)10/h8H,4-5H2,1-3H3

InChIKey

InChIKey=WANUOLLLVOSMFL-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Pentanoic acid, 2-acetyl-4-oxo-, ethyl ester
  • Levulinic acid, 2-acetyl-, ethyl ester
  • Ethyl 2-acetonylacetoacetate
  • Ethyl 2,5-dioxohexane-3-carboxylate
  • Ethyl 2-acetyl-4-oxopentanoate

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Deleted or Replaced CAS Registry Numbers

50990-90-4

CAS INSIGHTSTM
Targeted protein degrader structure, illustration