2-Nitro-5-(1-piperidinyl)benzonitrile

CAS Registry Number®

13514-94-8

CAS Name

2-Nitro-5-(1-piperidinyl)benzonitrile

Molecular Formula

C12H13N3O2

Molecular Mass

231.25

Cite this Page

2-Nitro-5-(1-piperidinyl)benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13514-94-8 (retrieved 2025-01-30) (CAS RN: 13514-94-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    129-130 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H13N3O2/c13-9-10-8-11(4-5-12(10)15(16)17)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2

InChIKey

InChIKey=VQHNRSWQEXMRKH-UHFFFAOYSA-N

SMILES

C(#N)C=1C=C(C=CC1N(=O)=O)N2CCCCC2

Canonical SMILES

N#CC1=CC(=CC=C1N(=O)=O)N2CCCCC2

Other Names for this Substance

  • Benzonitrile, 2-nitro-5-(1-piperidinyl)-
  • Benzonitrile, 2-nitro-5-piperidino-
  • 2-Nitro-5-(1-piperidinyl)benzonitrile
  • 2-Nitro-5-piperidinobenzonitrile
  • NSC 263788