U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C8H4N2
Molecular Weight 128.1308
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-DICYANOBENZENE

SMILES

N#CC1=CC(=CC=C1)C#N

InChI

InChIKey=LAQPNDIUHRHNCV-UHFFFAOYSA-N
InChI=1S/C8H4N2/c9-5-7-2-1-3-8(4-7)6-10/h1-4H

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Solid-state density functional theory investigation of the terahertz spectra of the structural isomers 1,2-dicyanobenzene and 1,3-dicyanobenzene.
2010-12-02
[One case of isophthalonitrile mixture burning combined with peripheral nerve injury].
2010-05
Solvent-free, microwave assisted synthesis of polyhalo heterocyclic ketene aminals as novel anti-cancer agents.
2010-01-01
Synergy effects of electric and magnetic fields on locally excited-state fluorescence of photoinduced electron transfer systems in a polymer film.
2009-10-08
Stereoselective desymmetrisation of prochiral alpha,alpha-dicyanoalkenes via domino Michael-Michael addition reactions.
2008-08-07
High-resolution waveguide terahertz spectroscopy of partially oriented organic polycrystalline films.
2007-11-01
Semi-quantitative immunohistochemical analysis of male rat-specific alpha2u-globulin accumulation for chemical toxicity evaluation.
2006-02
Steric effect on fluorescence quenching.
2005-07
Low-field optically detected EPR spectroscopy of transient photoinduced radical pairs.
2005-06-16
Scale-down studies on the hydrodynamics of two-liquid phase biocatalytic reactors.
2002-09
A one-pot access to 6-substituted phenanthridines from fluoroarenes and nitriles via 1,2-arynes.
2002-08-08
Patents

Patents

Name Type Language
NSC-87880
Preferred Name English
1,3-DICYANOBENZENE
HSDB  
Systematic Name English
ISOPHTHALONITRILE
Systematic Name English
M-BENZENEDINITRILE
Common Name English
3-CYANOBENZONITRILE
Systematic Name English
1,3-DICYANOBENZENE [HSDB]
Common Name English
M-PHTHALODINITRILE
Common Name English
M-DICYANOBENZENE
Systematic Name English
1,3-BIS(CYANO)BENZENE
Systematic Name English
META-DICYANOBENZENE
Systematic Name English
1,3-BENZODINITRILE
Common Name English
1,3-BENZENEDICARBONITRILE
Systematic Name English
Code System Code Type Description
PUBCHEM
12276
Created by admin on Mon Mar 31 19:14:28 GMT 2025 , Edited by admin on Mon Mar 31 19:14:28 GMT 2025
PRIMARY
WIKIPEDIA
Isophthalonitrile
Created by admin on Mon Mar 31 19:14:28 GMT 2025 , Edited by admin on Mon Mar 31 19:14:28 GMT 2025
PRIMARY
CHEBI
38218
Created by admin on Mon Mar 31 19:14:28 GMT 2025 , Edited by admin on Mon Mar 31 19:14:28 GMT 2025
PRIMARY
CAS
626-17-5
Created by admin on Mon Mar 31 19:14:28 GMT 2025 , Edited by admin on Mon Mar 31 19:14:28 GMT 2025
PRIMARY
FDA UNII
7G36N0292W
Created by admin on Mon Mar 31 19:14:28 GMT 2025 , Edited by admin on Mon Mar 31 19:14:28 GMT 2025
PRIMARY
ECHA (EC/EINECS)
210-933-7
Created by admin on Mon Mar 31 19:14:28 GMT 2025 , Edited by admin on Mon Mar 31 19:14:28 GMT 2025
PRIMARY
HSDB
5724
Created by admin on Mon Mar 31 19:14:28 GMT 2025 , Edited by admin on Mon Mar 31 19:14:28 GMT 2025
PRIMARY
NSC
87880
Created by admin on Mon Mar 31 19:14:28 GMT 2025 , Edited by admin on Mon Mar 31 19:14:28 GMT 2025
PRIMARY
EPA CompTox
DTXSID7027259
Created by admin on Mon Mar 31 19:14:28 GMT 2025 , Edited by admin on Mon Mar 31 19:14:28 GMT 2025
PRIMARY