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Details

Stereochemistry ACHIRAL
Molecular Formula C25H53N2O.C2H5O4S
Molecular Weight 522.825
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of STEARAMIDOPROPYL ETHYLDIMONIUM ETHOSULFATE

SMILES

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

InChI

InChIKey=WBJQGBBEPJLNKP-UHFFFAOYSA-N
InChI=1S/C25H52N2O.C2H6O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25(28)26-23-21-24-27(3,4)6-2;1-2-6-7(3,4)5/h5-24H2,1-4H3;2H2,1H3,(H,3,4,5)

HIDE SMILES / InChI

Molecular Formula C25H53N2O
Molecular Weight 397.7011
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C2H5O4S
Molecular Weight 125.124
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 Fri Dec 15 15:35:31 GMT 2023
Edited
by admin
on Fri Dec 15 15:35:31 GMT 2023
Record UNII
35XUP1PVY7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
STEARAMIDOPROPYL ETHYLDIMONIUM ETHOSULFATE
INCI  
INCI  
Official Name English
N-ETHYL-N,N-DIMETHYL-3-((1-OXOOCTADECYL)AMINO)-1-PROPANAMINIUM ETHYL SULFATE
Systematic Name English
1-PROPANAMINIUM, N-ETHYL-N,N-DIMETHYL-3-((1-OXOOCTADECYL)AMINO)-, ETHYL SULFATE
Common Name English
(OCTADECANOYLAMINOTRIMETHYLENE)DIMETHYLETHYLAMMONIUM ETHYL SULFATE
Common Name English
STEARAMIDOPROPYL ETHYL DIMONIUM ETHYL SULFATE
Common Name English
STEARAMIDOPROPYL ETHYLDIMONIUM ETHOSULFATE [INCI]
Common Name English
1-PROPANAMINIUM, N-ETHYL-N,N-DIMETHYL-3-((1-OXOOCTADECYL)AMINO)-, ETHYL SULFATE (1:1)
Common Name English
Code System Code Type Description
CAS
67846-16-6
Created by admin on Fri Dec 15 15:35:31 GMT 2023 , Edited by admin on Fri Dec 15 15:35:31 GMT 2023
PRIMARY
ECHA (EC/EINECS)
267-360-0
Created by admin on Fri Dec 15 15:35:31 GMT 2023 , Edited by admin on Fri Dec 15 15:35:31 GMT 2023
PRIMARY
FDA UNII
35XUP1PVY7
Created by admin on Fri Dec 15 15:35:31 GMT 2023 , Edited by admin on Fri Dec 15 15:35:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID3070701
Created by admin on Fri Dec 15 15:35:31 GMT 2023 , Edited by admin on Fri Dec 15 15:35:31 GMT 2023
PRIMARY
PUBCHEM
105793
Created by admin on Fri Dec 15 15:35:31 GMT 2023 , Edited by admin on Fri Dec 15 15:35:31 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE