5-Oxoheptanoic acid

CAS Registry Number®

3637-13-6
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CAS Name

5-Oxoheptanoic acid

Molecular Formula

C7H12O3

Molecular Mass

144.17

Cite this Page

5-Oxoheptanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3637-13-6 (retrieved 2024-08-15) (CAS RN: 3637-13-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    152-153 °C @ Press: 9 Torr

  • Melting Point (2)

    50 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H12O3/c1-2-6(8)4-3-5-7(9)10/h2-5H2,1H3,(H,9,10)

InChIKey

InChIKey=PHADZMIQVBXNAW-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Heptanoic acid, 5-oxo-
  • 5-Oxoheptanoic acid