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Details

Stereochemistry ACHIRAL
Molecular Formula C19H42NO2.Br
Molecular Weight 396.446
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Bis(2-hydroxyethyl)methyltetradecylammonium bromide

SMILES

[Br-].CCCCCCCCCCCCCC[N+](C)(CCO)CCO

InChI

InChIKey=BKZGOXOAOUFWEN-UHFFFAOYSA-M
InChI=1S/C19H42NO2.BrH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20(2,16-18-21)17-19-22;/h21-22H,3-19H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C19H42NO2
Molecular Weight 316.5423
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity NONE

Molecular Formula Br
Molecular Weight 79.904
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 Wed Apr 02 18:40:17 GMT 2025
Edited
by admin
on Wed Apr 02 18:40:17 GMT 2025
Record UNII
49S2SB4MVV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Bis(2-hydroxyethyl)methyltetradecylammonium bromide
Systematic Name English
1-Tetradecanaminium, N,N-bis(2-hydroxyethyl)-N-methyl-, bromide
Preferred Name English
1-Tetradecanaminium, N,N-bis(2-hydroxyethyl)-N-methyl-, bromide (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
23658421
Created by admin on Wed Apr 02 18:40:17 GMT 2025 , Edited by admin on Wed Apr 02 18:40:17 GMT 2025
PRIMARY
FDA UNII
49S2SB4MVV
Created by admin on Wed Apr 02 18:40:17 GMT 2025 , Edited by admin on Wed Apr 02 18:40:17 GMT 2025
PRIMARY
EPA CompTox
DTXSID90635365
Created by admin on Wed Apr 02 18:40:17 GMT 2025 , Edited by admin on Wed Apr 02 18:40:17 GMT 2025
PRIMARY
CAS
117782-92-0
Created by admin on Wed Apr 02 18:40:17 GMT 2025 , Edited by admin on Wed Apr 02 18:40:17 GMT 2025
PRIMARY
Related Record Type Details
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