4-Acetyl-4-methylheptanedinitrile

CAS Registry Number®

1681-17-0
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CAS Name

4-Acetyl-4-methylheptanedinitrile

Molecular Formula

C10H14N2O

Molecular Mass

178.23

Cite this Page

4-Acetyl-4-methylheptanedinitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1681-17-0 (retrieved 2024-05-20) (CAS RN: 1681-17-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    200-203 °C @ Press: 1.5 Torr

  • Melting Point (2)

    67 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H14N2O/c1-9(13)10(2,5-3-7-11)6-4-8-12/h3-6H2,1-2H3

InChIKey

InChIKey=XWNSFEAWWGGSKJ-UHFFFAOYSA-N

SMILES

C(CCC#N)(CCC#N)(C(C)=O)C

Canonical SMILES

N#CCCC(C(=O)C)(C)CCC#N

Other Names for this Substance

  • Heptanedinitrile, 4-acetyl-4-methyl-
  • 4-Acetyl-4-methylheptanedinitrile
  • 2,2-Bis(β-cyanoethyl)-3-butanone
  • 4-Acetyl-4-methylpimelonitrile
  • NSC 2767

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