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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H16N2O6S2
Molecular Weight 372.417
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,4?-Diamino-5,5?-dimethyl-2,2?-biphenyldisulfonic acid

SMILES

CC1=C(N)C=C(C(=C1)C2=CC(C)=C(N)C=C2S(O)(=O)=O)S(O)(=O)=O

InChI

InChIKey=PHICKPBIPXXFIP-UHFFFAOYSA-N
InChI=1S/C14H16N2O6S2/c1-7-3-9(13(5-11(7)15)23(17,18)19)10-4-8(2)12(16)6-14(10)24(20,21)22/h3-6H,15-16H2,1-2H3,(H,17,18,19)(H,20,21,22)

HIDE SMILES / InChI

Molecular Formula C14H16N2O6S2
Molecular Weight 372.417
Charge 0
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 Tue Apr 01 17:48:29 GMT 2025
Edited
by admin
on Tue Apr 01 17:48:29 GMT 2025
Record UNII
KT3A5Z33YY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4,4?-Diamino-5,5?-dimethyl-2,2?-biphenyldisulfonic acid
Systematic Name English
NSC-37128
Preferred Name English
[1,1?-Biphenyl]-2,2?-disulfonic acid, 4,4?-diamino-5,5?-dimethyl-
Systematic Name English
2,2?-Biphenyldisulfonic acid, 4,4?-diamino-5,5?-dimethyl-
Systematic Name English
4,4?-Diamino-5,5?-dimethyl[1,1?-biphenyl]-2,2?-disulfonic acid
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID8058900
Created by admin on Tue Apr 01 17:48:29 GMT 2025 , Edited by admin on Tue Apr 01 17:48:29 GMT 2025
PRIMARY
NSC
37128
Created by admin on Tue Apr 01 17:48:29 GMT 2025 , Edited by admin on Tue Apr 01 17:48:29 GMT 2025
PRIMARY
ECHA (EC/EINECS)
201-505-0
Created by admin on Tue Apr 01 17:48:29 GMT 2025 , Edited by admin on Tue Apr 01 17:48:29 GMT 2025
PRIMARY
CAS
83-83-0
Created by admin on Tue Apr 01 17:48:29 GMT 2025 , Edited by admin on Tue Apr 01 17:48:29 GMT 2025
PRIMARY
FDA UNII
KT3A5Z33YY
Created by admin on Tue Apr 01 17:48:29 GMT 2025 , Edited by admin on Tue Apr 01 17:48:29 GMT 2025
PRIMARY
PUBCHEM
66527
Created by admin on Tue Apr 01 17:48:29 GMT 2025 , Edited by admin on Tue Apr 01 17:48:29 GMT 2025
PRIMARY