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Details

Stereochemistry ACHIRAL
Molecular Formula C18H35O2.C6H15O3S
Molecular Weight 450.716
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIS(2-HYDROXYETHYL)SULFONIUM STEARATE

SMILES

OCC[S+](CCO)CCO.CCCCCCCCCCCCCCCCCC([O-])=O

InChI

InChIKey=RLAAQIIKPXWKPU-UHFFFAOYSA-M
InChI=1S/C18H36O2.C6H15O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;7-1-4-10(5-2-8)6-3-9/h2-17H2,1H3,(H,19,20);7-9H,1-6H2/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C18H36O2
Molecular Weight 284.4772
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H14O3S
Molecular Weight 166.239
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 19:25:21 GMT 2025
Edited
by admin
on Tue Apr 01 19:25:21 GMT 2025
Record UNII
8P8Y2YJ3D2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SULFONIUM, TRIS(2-HYDROXYETHYL)-, OCTADECANOATE (1:1)
Preferred Name English
TRIS(2-HYDROXYETHYL)SULFONIUM STEARATE
Systematic Name English
OCTADECANOATE,TRIS(2-HYDROXYETHYL)SULFANIUM
Systematic Name English
Code System Code Type Description
PUBCHEM
3015466
Created by admin on Tue Apr 01 19:25:21 GMT 2025 , Edited by admin on Tue Apr 01 19:25:21 GMT 2025
PRIMARY
ECHA (EC/EINECS)
249-604-8
Created by admin on Tue Apr 01 19:25:21 GMT 2025 , Edited by admin on Tue Apr 01 19:25:21 GMT 2025
PRIMARY
CAS
29398-82-1
Created by admin on Tue Apr 01 19:25:21 GMT 2025 , Edited by admin on Tue Apr 01 19:25:21 GMT 2025
PRIMARY
EPA CompTox
DTXSID30183618
Created by admin on Tue Apr 01 19:25:21 GMT 2025 , Edited by admin on Tue Apr 01 19:25:21 GMT 2025
PRIMARY
FDA UNII
8P8Y2YJ3D2
Created by admin on Tue Apr 01 19:25:21 GMT 2025 , Edited by admin on Tue Apr 01 19:25:21 GMT 2025
PRIMARY