Heptanoic acid, heptyl ester

CAS Registry Number®

624-09-9

CAS Name

Heptanoic acid, heptyl ester

Molecular Formula

C14H28O2

Molecular Mass

228.37

Cite this Page

Heptanoic acid, heptyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=624-09-9 (retrieved 2025-03-31) (CAS RN: 624-09-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    96-97 °C @ Press: 1 Torr

  • Melting Point (2)

    -33 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H28O2/c1-3-5-7-9-11-13-16-14(15)12-10-8-6-4-2/h3-13H2,1-2H3

InChIKey

InChIKey=QOIIBPAJVWFEPE-UHFFFAOYSA-N

SMILES

C(OCCCCCCC)(CCCCCC)=O

Canonical SMILES

O=C(OCCCCCCC)CCCCCC

Other Names for this Substance

  • Heptanoic acid, heptyl ester
  • Heptyl heptoate
  • Heptyl heptanoate
  • 1-Heptyl heptanoate

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