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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H17N6.CH3O4S
Molecular Weight 356.401
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BASIC RED 22

SMILES

COS([O-])(=O)=O.CN(C)C1=CC=C(C=C1)\N=N\C2=[N+](C)C=NN2C

InChI

InChIKey=ZRVPOURSNDQODC-UHFFFAOYSA-M
InChI=1S/C12H17N6.CH4O4S/c1-16(2)11-7-5-10(6-8-11)14-15-12-17(3)9-13-18(12)4;1-5-6(2,3)4/h5-9H,1-4H3;1H3,(H,2,3,4)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C12H17N6
Molecular Weight 245.3036
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula CH3O4S
Molecular Weight 111.097
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:10:22 GMT 2023
Edited
by admin
on Fri Dec 15 19:10:22 GMT 2023
Record UNII
7W576V407R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BASIC RED 22
INCI  
INCI  
Official Name English
CI 11055
Common Name English
4H-1,2,4-TRIAZOLIUM, 5-(2-(4-(DIETHYLAMINO)PHENYL)DIAZENYL)-1,4-DIMETHYL-, METHYL SULFATE (1:1)
Systematic Name English
BASIC RED 22 [INCI]
Common Name English
BASIC RED 22 METHOSULFATE
Common Name English
SYNACRIL RED 3B
Common Name English
C.I. BASIC RED 22
Common Name English
C.I. 11055
Common Name English
Code System Code Type Description
CAS
12221-52-2
Created by admin on Fri Dec 15 19:10:22 GMT 2023 , Edited by admin on Fri Dec 15 19:10:22 GMT 2023
PRIMARY
ECHA (EC/EINECS)
245-718-7
Created by admin on Fri Dec 15 19:10:22 GMT 2023 , Edited by admin on Fri Dec 15 19:10:22 GMT 2023
PRIMARY
CAS
23532-28-7
Created by admin on Fri Dec 15 19:10:22 GMT 2023 , Edited by admin on Fri Dec 15 19:10:22 GMT 2023
ALTERNATIVE
EPA CompTox
DTXSID00904357
Created by admin on Fri Dec 15 19:10:22 GMT 2023 , Edited by admin on Fri Dec 15 19:10:22 GMT 2023
PRIMARY
MESH
C062964
Created by admin on Fri Dec 15 19:10:22 GMT 2023 , Edited by admin on Fri Dec 15 19:10:22 GMT 2023
PRIMARY
FDA UNII
7W576V407R
Created by admin on Fri Dec 15 19:10:22 GMT 2023 , Edited by admin on Fri Dec 15 19:10:22 GMT 2023
PRIMARY
PUBCHEM
73759884
Created by admin on Fri Dec 15 19:10:22 GMT 2023 , Edited by admin on Fri Dec 15 19:10:22 GMT 2023
PRIMARY