5-Oxo-2-propylhexanoic acid

CAS Registry Number®

10297-76-4
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CAS Name

5-Oxo-2-propylhexanoic acid

Molecular Formula

C9H16O3

Molecular Mass

172.22

Cite this Page

5-Oxo-2-propylhexanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=10297-76-4 (retrieved 2024-08-22) (CAS RN: 10297-76-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    151-154 °C @ Press: 6 Torr

  • Density (1)

    1.0206 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H16O3/c1-3-4-8(9(11)12)6-5-7(2)10/h8H,3-6H2,1-2H3,(H,11,12)

InChIKey

InChIKey=WHJQRBCIFNCODR-UHFFFAOYSA-N

SMILES

C(CCC(C)=O)(CCC)C(O)=O

Canonical SMILES

O=C(O)C(CCC(=O)C)CCC

Other Names for this Substance

  • Hexanoic acid, 5-oxo-2-propyl-
  • 5-Oxo-2-propylhexanoic acid