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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H9O3S.Na
Molecular Weight 304.296
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sodium 1-pyrenesulfonate

SMILES

[Na+].[O-]S(=O)(=O)C1=C2C=CC3=CC=CC4=CC=C(C=C1)C2=C34

InChI

InChIKey=HCOPYCNNZOWMTD-UHFFFAOYSA-M
InChI=1S/C16H10O3S.Na/c17-20(18,19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11;/h1-9H,(H,17,18,19);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
Sodium pyrene-1-sulfonate
Preferred Name English
Sodium 1-pyrenesulfonate
Common Name English
1-Pyrenesulfonic acid, sodium salt (1:1)
Systematic Name English
1-Pyrenesulfonic acid, sodium salt
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID60208060
Created by admin on Tue Apr 01 19:36:02 GMT 2025 , Edited by admin on Tue Apr 01 19:36:02 GMT 2025
PRIMARY
PUBCHEM
23674489
Created by admin on Tue Apr 01 19:36:02 GMT 2025 , Edited by admin on Tue Apr 01 19:36:02 GMT 2025
PRIMARY
CAS
59323-54-5
Created by admin on Tue Apr 01 19:36:02 GMT 2025 , Edited by admin on Tue Apr 01 19:36:02 GMT 2025
PRIMARY
FDA UNII
MY7U5L5NRU
Created by admin on Tue Apr 01 19:36:02 GMT 2025 , Edited by admin on Tue Apr 01 19:36:02 GMT 2025
PRIMARY
ECHA (EC/EINECS)
261-698-2
Created by admin on Tue Apr 01 19:36:02 GMT 2025 , Edited by admin on Tue Apr 01 19:36:02 GMT 2025
PRIMARY