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Details

Stereochemistry ACHIRAL
Molecular Formula C10H11O3S.Na
Molecular Weight 234.247
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sodium 5,6,7,8-tetrahydronaphthalene-2-sulfonate

SMILES

[Na+].[O-]S(=O)(=O)C1=CC2=C(CCCC2)C=C1

InChI

InChIKey=IKFUOWLTOBNMNS-UHFFFAOYSA-M
InChI=1S/C10H12O3S.Na/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10;/h5-7H,1-4H2,(H,11,12,13);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C10H11O3S
Molecular Weight 211.258
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 Tue Apr 01 19:05:59 GMT 2025
Edited
by admin
on Tue Apr 01 19:05:59 GMT 2025
Record UNII
QNG78B64F8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Naphthalenesulfonic acid, 5,6,7,8-tetrahydro-, sodium salt
Preferred Name English
Sodium 5,6,7,8-tetrahydronaphthalene-2-sulfonate
Systematic Name English
Sodium 5,6,7,8-tetrahydronaphthalene-2-sulphonate
Systematic Name English
Code System Code Type Description
CAS
135-80-8
Created by admin on Tue Apr 01 19:05:59 GMT 2025 , Edited by admin on Tue Apr 01 19:05:59 GMT 2025
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FDA UNII
QNG78B64F8
Created by admin on Tue Apr 01 19:05:59 GMT 2025 , Edited by admin on Tue Apr 01 19:05:59 GMT 2025
PRIMARY
ECHA (EC/EINECS)
205-221-8
Created by admin on Tue Apr 01 19:05:59 GMT 2025 , Edited by admin on Tue Apr 01 19:05:59 GMT 2025
PRIMARY
EPA CompTox
DTXSID0059661
Created by admin on Tue Apr 01 19:05:59 GMT 2025 , Edited by admin on Tue Apr 01 19:05:59 GMT 2025
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PUBCHEM
23667649
Created by admin on Tue Apr 01 19:05:59 GMT 2025 , Edited by admin on Tue Apr 01 19:05:59 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE