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Details

Stereochemistry ACHIRAL
Molecular Formula C24H52NO2.C2H5O4S
Molecular Weight 511.799
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethylbis(hydroxyethyl)octadecylammonium ethyl sulfate

SMILES

CCOS([O-])(=O)=O.CCCCCCCCCCCCCCCCCC[N+](CC)(CCO)CCO

InChI

InChIKey=YQBWZZAMGYURCV-UHFFFAOYSA-M
InChI=1S/C24H52NO2.C2H6O4S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(4-2,21-23-26)22-24-27;1-2-6-7(3,4)5/h26-27H,3-24H2,1-2H3;2H2,1H3,(H,3,4,5)/q+1;/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
Ethylbis(hydroxyethyl)octadecylammonium ethyl sulfate
Common Name English
1-Octadecanaminium, N-ethyl-N,N-bis(2-hydroxyethyl)-, ethyl sulfate (salt)
Preferred Name English
1-Octadecanaminium, N-ethyl-N,N-bis(2-hydroxyethyl)-, ethyl sulfate (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
T5Y95ULD79
Created by admin on Tue Apr 01 17:41:07 GMT 2025 , Edited by admin on Tue Apr 01 17:41:07 GMT 2025
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PUBCHEM
171014
Created by admin on Tue Apr 01 17:41:07 GMT 2025 , Edited by admin on Tue Apr 01 17:41:07 GMT 2025
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ECHA (EC/EINECS)
257-103-0
Created by admin on Tue Apr 01 17:41:07 GMT 2025 , Edited by admin on Tue Apr 01 17:41:07 GMT 2025
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CAS
51277-02-2
Created by admin on Tue Apr 01 17:41:07 GMT 2025 , Edited by admin on Tue Apr 01 17:41:07 GMT 2025
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EPA CompTox
DTXSID8068628
Created by admin on Tue Apr 01 17:41:07 GMT 2025 , Edited by admin on Tue Apr 01 17:41:07 GMT 2025
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