3-Chloro-2,4-pentanedione

CAS Registry Number®

1694-29-7

CAS Name

3-Chloro-2,4-pentanedione

Molecular Formula

C5H7ClO2

Molecular Mass

134.56

Cite this Page

3-Chloro-2,4-pentanedione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1694-29-7 (retrieved 2024-11-22) (CAS RN: 1694-29-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    152 °C @ Press: 708 Torr

  • Melting Point (2)

    41-44.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C5H7ClO2/c1-3(7)5(6)4(2)8/h5H,1-2H3

InChIKey

InChIKey=VLRGXXKFHVJQOL-UHFFFAOYSA-N

SMILES

C(C(C)=O)(C(C)=O)Cl

Canonical SMILES

O=C(C)C(Cl)C(=O)C

Other Names for this Substance

  • 2,4-Pentanedione, 3-chloro-
  • 3-Chloro-2,4-pentanedione
  • 3-Chloroacetylacetone
  • 1-Acetyl-1-chloroacetone
  • 3-Chloro-2,4-dioxopentane

View All

CAS INSIGHTSTM
Targeted protein degrader structure, illustration