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

Details

Stereochemistry ACHIRAL
Molecular Formula 2C13H18N5.Cl4Zn
Molecular Weight 695.852
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 2-[2-[4-(Dimethylamino)phenyl]diazenyl]-1,3-dimethyl-1H-imidazolium tetrachlorozincate

SMILES

[Cl-][Zn++]([Cl-])([Cl-])[Cl-].CN(C)C1=CC=C(C=C1)\N=N\C2=[N+](C)C=CN2C.CN(C)C3=CC=C(C=C3)\N=N\C4=[N+](C)C=CN4C

InChI

InChIKey=KNPZXIWCTUFKQU-UHFFFAOYSA-J
InChI=1S/2C13H18N5.4ClH.Zn/c2*1-16(2)12-7-5-11(6-8-12)14-15-13-17(3)9-10-18(13)4;;;;;/h2*5-10H,1-4H3;4*1H;/q2*+1;;;;;+2/p-4

HIDE SMILES / InChI

Approval Year

Name Type Language
2-[2-[4-(Dimethylamino)phenyl]diazenyl]-1,3-dimethyl-1H-imidazolium tetrachlorozincate
Systematic Name English
1H-Imidazolium, 2-((4-(dimethylamino)phenyl)azo)-1,3-dimethyl-, (T-4)-tetrachlorozincate(2-) (2:1)
Preferred Name English
1H-Imidazolium, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-1,3-dimethyl-, (T-4)-tetrachlorozincate(2-) (2:1)
Systematic Name English
Bis[2-[[p-(dimethylamino)phenyl]azo]-1,3-dimethylimidazolium] tetrachlorozincate
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID40988651
Created by admin on Wed Apr 02 17:37:50 GMT 2025 , Edited by admin on Wed Apr 02 17:37:50 GMT 2025
PRIMARY
CAS
68936-17-4
Created by admin on Wed Apr 02 17:37:50 GMT 2025 , Edited by admin on Wed Apr 02 17:37:50 GMT 2025
PRIMARY
PUBCHEM
163293
Created by admin on Wed Apr 02 17:37:50 GMT 2025 , Edited by admin on Wed Apr 02 17:37:50 GMT 2025
PRIMARY
FDA UNII
Q867ME732N
Created by admin on Wed Apr 02 17:37:50 GMT 2025 , Edited by admin on Wed Apr 02 17:37:50 GMT 2025
PRIMARY