Heptyl hexanoate

CAS Registry Number®

6976-72-3

CAS Name

Heptyl hexanoate

Molecular Formula

C13H26O2

Molecular Mass

214.34

Cite this Page

Heptyl hexanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6976-72-3 (retrieved 2024-11-21) (CAS RN: 6976-72-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    261 °C

  • Melting Point (1)

    -34.4 °C

  • Density (2)

    0.8616 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H26O2/c1-3-5-7-8-10-12-15-13(14)11-9-6-4-2/h3-12H2,1-2H3

InChIKey

InChIKey=QEKCBKVWQYEUGY-UHFFFAOYSA-N

SMILES

C(OCCCCCCC)(CCCCC)=O

Canonical SMILES

O=C(OCCCCCCC)CCCCC

Other Names for this Substance

  • Hexanoic acid, heptyl ester
  • Heptyl hexanoate
  • 1-Heptyl hexanoate
  • Heptyl caproate
  • NSC 24779

CAS INSIGHTSTM
Targeted protein degrader structure, illustration