1-Ethyl heptanedioate

CAS Registry Number®

33018-91-6
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CAS Name

1-Ethyl heptanedioate

Molecular Formula

C9H16O4

Molecular Mass

188.22

Cite this Page

1-Ethyl heptanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=33018-91-6 (retrieved 2024-04-29) (CAS RN: 33018-91-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    182 °C @ Press: 18 Torr
  • Melting Point (2)

    10 °C
  • Density (3)

    0.9929 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H16O4/c1-2-13-9(12)7-5-3-4-6-8(10)11/h2-7H2,1H3,(H,10,11)

InChIKey

InChIKey=NQYXFXWKKYGBNL-UHFFFAOYSA-N

SMILES

C(CC(OCC)=O)CCCC(O)=O

Canonical SMILES

O=C(O)CCCCCC(=O)OCC

Other Names for this Substance

  • Heptanedioic acid, 1-ethyl ester
  • Pimelic acid, monoethyl ester
  • Heptanedioic acid, monoethyl ester
  • Pimelic acid, ethyl ester
  • 1-Ethyl heptanedioate

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