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Details

Stereochemistry ACHIRAL
Molecular Formula C15H32NO2.I
Molecular Weight 385.3246
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Decanoyloxyethyl(trimethyl)azanium iodide

SMILES

[I-].CCCCCCCCCC(=O)OCC[N+](C)(C)C

InChI

InChIKey=YNYTZCYECQCXMN-UHFFFAOYSA-M
InChI=1S/C15H32NO2.HI/c1-5-6-7-8-9-10-11-12-15(17)18-14-13-16(2,3)4;/h5-14H2,1-4H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula I
Molecular Weight 126.90447
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C15H32NO2
Molecular Weight 258.4201
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:58:20 GMT 2025
Edited
by admin
on Wed Apr 02 17:58:20 GMT 2025
Record UNII
Y9F7J6QL2V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Choline, iodide, decanoate
Preferred Name English
2-Decanoyloxyethyl(trimethyl)azanium iodide
Systematic Name English
Ethanaminium, N,N,N-trimethyl-2-[(1-oxodecyl)oxy]-, iodide (1:1)
Systematic Name English
Ethanaminium, N,N,N-trimethyl-2-[(1-oxodecyl)oxy]-, iodide
Systematic Name English
Code System Code Type Description
FDA UNII
Y9F7J6QL2V
Created by admin on Wed Apr 02 17:58:20 GMT 2025 , Edited by admin on Wed Apr 02 17:58:20 GMT 2025
PRIMARY
CAS
26640-67-5
Created by admin on Wed Apr 02 17:58:20 GMT 2025 , Edited by admin on Wed Apr 02 17:58:20 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE