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Details

Stereochemistry ACHIRAL
Molecular Formula C11H21N2.Br
Molecular Weight 261.202
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-Dibutylimidazolium bromide

SMILES

[Br-].CCCCN1C=C[N+](CCCC)=C1

InChI

InChIKey=XUZFNEAIMDGBMY-UHFFFAOYSA-M
InChI=1S/C11H21N2.BrH/c1-3-5-7-12-9-10-13(11-12)8-6-4-2;/h9-11H,3-8H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

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

Molecular Formula C11H21N2
Molecular Weight 181.2978
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 19:09:36 GMT 2025
Edited
by admin
on Wed Apr 02 19:09:36 GMT 2025
Record UNII
TL98Q3N9M6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-Dibutyl-1H-imidazol-3-ium bromide
Preferred Name English
1,3-Dibutylimidazolium bromide
Common Name English
1H-Imidazolium, 1,3-dibutyl-, bromide (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
11448364
Created by admin on Wed Apr 02 19:09:36 GMT 2025 , Edited by admin on Wed Apr 02 19:09:36 GMT 2025
PRIMARY
CAS
87266-38-4
Created by admin on Wed Apr 02 19:09:36 GMT 2025 , Edited by admin on Wed Apr 02 19:09:36 GMT 2025
PRIMARY
FDA UNII
TL98Q3N9M6
Created by admin on Wed Apr 02 19:09:36 GMT 2025 , Edited by admin on Wed Apr 02 19:09:36 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE