7-Methyloctanoic acid

CAS Registry Number®

693-19-6

CAS Name

7-Methyloctanoic acid

Molecular Formula

C9H18O2

Molecular Mass

158.24

Cite this Page

7-Methyloctanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=693-19-6 (retrieved 2024-11-23) (CAS RN: 693-19-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    140.5 °C @ Press: 15 Torr

  • Melting Point (2)

    3-5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H18O2/c1-8(2)6-4-3-5-7-9(10)11/h8H,3-7H2,1-2H3,(H,10,11)

InChIKey

InChIKey=XZOYHFBNQHPJRQ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)CCCCCC(C)C

Other Names for this Substance

  • Octanoic acid, 7-methyl-
  • 7-Methyloctanoic acid
  • Isopelargonic acid
  • Isononanoic acid

CAS INSIGHTSTM
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