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Details

Stereochemistry ACHIRAL
Molecular Formula C19H31O3S.Na
Molecular Weight 362.502
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 3-TRIDECYLBENZENESULFONATE

SMILES

[Na+].CCCCCCCCCCCCCC1=CC(=CC=C1)S([O-])(=O)=O

InChI

InChIKey=JZJODLWMQNCLHV-UHFFFAOYSA-M
InChI=1S/C19H32O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-14-18-15-13-16-19(17-18)23(20,21)22;/h13,15-17H,2-12,14H2,1H3,(H,20,21,22);/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 C19H31O3S
Molecular Weight 339.513
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 Mon Mar 31 22:14:03 GMT 2025
Edited
by admin
on Mon Mar 31 22:14:03 GMT 2025
Record UNII
D4JQB2I4VK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZENESULFONIC ACID, 3-TRIDECYL-, SODIUM SALT
Preferred Name English
SODIUM 3-TRIDECYLBENZENESULFONATE
Systematic Name English
BENZENESULFONIC ACID, 3-TRIDECYL-, SODIUM SALT (1:1)
Systematic Name English
SODIUM 3-TRIDECYLBENZENESULPHONATE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
287-158-6
Created by admin on Mon Mar 31 22:14:03 GMT 2025 , Edited by admin on Mon Mar 31 22:14:03 GMT 2025
PRIMARY
PUBCHEM
23662540
Created by admin on Mon Mar 31 22:14:03 GMT 2025 , Edited by admin on Mon Mar 31 22:14:03 GMT 2025
PRIMARY
FDA UNII
D4JQB2I4VK
Created by admin on Mon Mar 31 22:14:03 GMT 2025 , Edited by admin on Mon Mar 31 22:14:03 GMT 2025
PRIMARY
EPA CompTox
DTXSID90234630
Created by admin on Mon Mar 31 22:14:03 GMT 2025 , Edited by admin on Mon Mar 31 22:14:03 GMT 2025
PRIMARY
CAS
85409-86-5
Created by admin on Mon Mar 31 22:14:03 GMT 2025 , Edited by admin on Mon Mar 31 22:14:03 GMT 2025
PRIMARY