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Details

Stereochemistry ACHIRAL
Molecular Formula C21H38N.Br
Molecular Weight 384.437
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CETYLPYRIDINIUM BROMIDE

SMILES

[Br-].CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1

InChI

InChIKey=DVBJBNKEBPCGSY-UHFFFAOYSA-M
InChI=1S/C21H38N.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22;/h15,17-18,20-21H,2-14,16,19H2,1H3;1H/q+1;/p-1

HIDE SMILES / InChI

Approval Year

Unknown
86413
Name Type Language
CETYLPYRIDINIUM BROMIDE
HSDB   WHO-DD  
Systematic Name English
1-HEXADECYLPYRIDINIUM BROMIDE
Systematic Name English
PYRIDINIUM, 1-HEXADECYL-, BROMIDE
Systematic Name English
CETYLPYRIDINIUM BROMIDE [HSDB]
Common Name English
NSC-8495
Code English
Cetylpyridinium bromide [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C28394
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
Code System Code Type Description
PUBCHEM
8816
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
PRIMARY
HSDB
6859
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
PRIMARY
DRUG BANK
DBSALT002695
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
PRIMARY
EPA CompTox
DTXSID3033307
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
PRIMARY
NCI_THESAURUS
C83617
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
PRIMARY
CAS
140-72-7
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
PRIMARY
NSC
8495
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
PRIMARY
FDA UNII
O77BKZ14DE
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
PRIMARY
CHEBI
77052
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
PRIMARY
ECHA (EC/EINECS)
205-428-3
Created by admin on Fri Dec 15 15:22:38 UTC 2023 , Edited by admin on Fri Dec 15 15:22:38 UTC 2023
PRIMARY
PARENT (SALT/SOLVATE)
Structure of CETYLPYRIDINIUM
NIH
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