Heptyl 3-oxobutanoate

CAS Registry Number®

42598-96-9

CAS Name

Heptyl 3-oxobutanoate

Molecular Formula

C11H20O3

Molecular Mass

200.27

Cite this Page

Heptyl 3-oxobutanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=42598-96-9 (retrieved 2024-11-22) (CAS RN: 42598-96-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    78-80 °C @ Press: 0.4 Torr

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C11H20O3/c1-3-4-5-6-7-8-14-11(13)9-10(2)12/h3-9H2,1-2H3

InChIKey

InChIKey=YAVJSVDUZGIQPQ-UHFFFAOYSA-N

SMILES

C(OCCCCCCC)(CC(C)=O)=O

Canonical SMILES

O=C(OCCCCCCC)CC(=O)C

Other Names for this Substance

  • Butanoic acid, 3-oxo-, heptyl ester
  • Heptyl 3-oxobutanoate
  • Heptyl acetoacetate
  • n-Heptyl acetylacetate
  • NSC 33607

CAS INSIGHTSTM
Targeted protein degrader structure, illustration