1,3-Diethyl 2-(1-cyano-3-methylbutyl)propanedioate

CAS Registry Number®

186038-82-4
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CAS Name

1,3-Diethyl 2-(1-cyano-3-methylbutyl)propanedioate

Molecular Formula

C13H21NO4

Molecular Mass

255.31

Cite this Page

1,3-Diethyl 2-(1-cyano-3-methylbutyl)propanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=186038-82-4 (retrieved 2024-08-22) (CAS RN: 186038-82-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H21NO4/c1-5-17-12(15)11(13(16)18-6-2)10(8-14)7-9(3)4/h9-11H,5-7H2,1-4H3

InChIKey

InChIKey=PZGIWBPMOSUKEV-UHFFFAOYSA-N

SMILES

C(C(CC(C)C)C#N)(C(OCC)=O)C(OCC)=O

Canonical SMILES

N#CC(CC(C)C)C(C(=O)OCC)C(=O)OCC

Other Names for this Substance

  • Propanedioic acid, 2-(1-cyano-3-methylbutyl)-, 1,3-diethyl ester
  • Propanedioic acid, (1-cyano-3-methylbutyl)-, diethyl ester
  • 1,3-Diethyl 2-(1-cyano-3-methylbutyl)propanedioate
  • 2-Ethoxycarbonyl-3-cyano-5-methylhexanoic acid ethyl ester