Heptanoic acid, 6-oxo-, methyl ester

CAS Registry Number®

2046-21-1
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CAS Name

Heptanoic acid, 6-oxo-, methyl ester

Molecular Formula

C8H14O3

Molecular Mass

158.20

Cite this Page

Heptanoic acid, 6-oxo-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2046-21-1 (retrieved 2024-08-31) (CAS RN: 2046-21-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    140-142 °C @ Press: 0.8 Torr

  • Density (1)

    1.0636 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H14O3/c1-7(9)5-3-4-6-8(10)11-2/h3-6H2,1-2H3

InChIKey

InChIKey=BSBYQAYWPXHLPQ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC)CCCCC(=O)C

Other Names for this Substance

  • Heptanoic acid, 6-oxo-, methyl ester
  • Methyl 6-oxoheptanoate
  • 6-Oxoheptanoic acid methyl ester
  • NSC 148317