2,3-Heptanedione

CAS Registry Number®

96-04-8

CAS Name

2,3-Heptanedione

Molecular Formula

C7H12O2

Molecular Mass

128.17

Cite this Page

2,3-Heptanedione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=96-04-8 (retrieved 2025-03-29) (CAS RN: 96-04-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    44-45 °C @ Press: 10 Torr

  • Density (2)

    0.9241 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H12O2/c1-3-4-5-7(9)6(2)8/h3-5H2,1-2H3

InChIKey

InChIKey=FJPGAMCQJNLTJC-UHFFFAOYSA-N

SMILES

C(C(C)=O)(CCCC)=O

Canonical SMILES

O=C(C(=O)CCCC)C

Other Names for this Substance

  • 2,3-Heptanedione
  • Acetylvaleryl
  • Valerylacetyl
  • NSC 31668
  • Heptan-2,3-dione

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