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Details

Stereochemistry ACHIRAL
Molecular Formula C10H16N.Br
Molecular Weight 230.145
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Butyl-2-methylpyridinium bromide

SMILES

[Br-].CCCC[N+]1=C(C)C=CC=C1

InChI

InChIKey=QVHDOABFJHOTIT-UHFFFAOYSA-M
InChI=1S/C10H16N.BrH/c1-3-4-8-11-9-6-5-7-10(11)2;/h5-7,9H,3-4,8H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C10H16N
Molecular Weight 150.2407
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
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 Mon Mar 31 22:12:21 GMT 2025
Edited
by admin
on Mon Mar 31 22:12:21 GMT 2025
Record UNII
46VNA2U525
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Picolinium, 1-butyl-, bromide
Preferred Name English
1-Butyl-2-methylpyridinium bromide
Systematic Name English
Pyridinium, 1-butyl-2-methyl-, bromide (1:1)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID8049258
Created by admin on Mon Mar 31 22:12:21 GMT 2025 , Edited by admin on Mon Mar 31 22:12:21 GMT 2025
PRIMARY
CAS
26576-84-1
Created by admin on Mon Mar 31 22:12:21 GMT 2025 , Edited by admin on Mon Mar 31 22:12:21 GMT 2025
PRIMARY
PUBCHEM
13240377
Created by admin on Mon Mar 31 22:12:21 GMT 2025 , Edited by admin on Mon Mar 31 22:12:21 GMT 2025
PRIMARY
FDA UNII
46VNA2U525
Created by admin on Mon Mar 31 22:12:21 GMT 2025 , Edited by admin on Mon Mar 31 22:12:21 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE