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Details

Stereochemistry ACHIRAL
Molecular Formula C21H16O6S2
Molecular Weight 428.478
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1?-Methylenebis[2-naphthalenesulfonic acid]

SMILES

OS(=O)(=O)C1=CC=C2C=CC=CC2=C1CC3=C4C=CC=CC4=CC=C3S(O)(=O)=O

InChI

InChIKey=DQBNLFRFALCILS-UHFFFAOYSA-N
InChI=1S/C21H16O6S2/c22-28(23,24)20-11-9-14-5-1-3-7-16(14)18(20)13-19-17-8-4-2-6-15(17)10-12-21(19)29(25,26)27/h1-12H,13H2,(H,22,23,24)(H,25,26,27)

HIDE SMILES / InChI

Molecular Formula C21H16O6S2
Molecular Weight 428.478
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 Wed Apr 02 17:57:08 GMT 2025
Edited
by admin
on Wed Apr 02 17:57:08 GMT 2025
Record UNII
QY9U5VE39H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,1?-Methylenebis[2-naphthalenesulfonic acid]
Systematic Name English
1,1?-Methylenebisnaphthalene-2-sulphonicacid
Preferred Name English
2-Naphthalenesulfonic acid, 1,1?-methylenebis-
Systematic Name English
Code System Code Type Description
FDA UNII
QY9U5VE39H
Created by admin on Wed Apr 02 17:57:08 GMT 2025 , Edited by admin on Wed Apr 02 17:57:08 GMT 2025
PRIMARY
PUBCHEM
66543
Created by admin on Wed Apr 02 17:57:08 GMT 2025 , Edited by admin on Wed Apr 02 17:57:08 GMT 2025
PRIMARY
CAS
84-90-2
Created by admin on Wed Apr 02 17:57:08 GMT 2025 , Edited by admin on Wed Apr 02 17:57:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID60861659
Created by admin on Wed Apr 02 17:57:08 GMT 2025 , Edited by admin on Wed Apr 02 17:57:08 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT