Propyl hexanoate

CAS Registry Number®

626-77-7

CAS Name

Propyl hexanoate

Molecular Formula

C9H18O2

Molecular Mass

158.24

Cite this Page

Propyl hexanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=626-77-7 (retrieved 2025-03-29) (CAS RN: 626-77-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    85.28 °C @ Press: 20 Torr

  • Melting Point (2)

    -68.7 °C

  • Density (1)

    0.8847 g/cm³ @ Temp: 0 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H18O2/c1-3-5-6-7-9(10)11-8-4-2/h3-8H2,1-2H3

InChIKey

InChIKey=HTUIWRWYYVBCFT-UHFFFAOYSA-N

SMILES

C(C(OCCC)=O)CCCC

Canonical SMILES

O=C(OCCC)CCCCC

Other Names for this Substance

  • Hexanoic acid, propyl ester
  • Propyl caproate
  • Propyl hexanoate
  • 1-Propyl n-caproate
  • NSC 53784

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