Heptyl pentanoate

CAS Registry Number®

5451-80-9

CAS Name

Heptyl pentanoate

Molecular Formula

C12H24O2

Molecular Mass

200.32

Cite this Page

Heptyl pentanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5451-80-9 (retrieved 2024-12-23) (CAS RN: 5451-80-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    245.2 °C

  • Melting Point (1)

    -46.4 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C12H24O2/c1-3-5-7-8-9-11-14-12(13)10-6-4-2/h3-11H2,1-2H3

InChIKey

InChIKey=YJARPRLGQQFGOI-UHFFFAOYSA-N

SMILES

C(OCCCCCCC)(CCCC)=O

Canonical SMILES

O=C(OCCCCCCC)CCCC

Other Names for this Substance

  • Pentanoic acid, heptyl ester
  • Valeric acid, heptyl ester
  • 39840N
  • Heptyl valerate
  • ENT 30517

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