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Details

Stereochemistry ACHIRAL
Molecular Formula C25H46N.Br
Molecular Weight 440.543
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CETALKONIUM BROMIDE

SMILES

[Br-].CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1

InChI

InChIKey=DLNWMWYCSOQYSQ-UHFFFAOYSA-M
InChI=1S/C25H46N.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(2,3)24-25-21-18-17-19-22-25;/h17-19,21-22H,4-16,20,23-24H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
CETALKONIUM BROMIDE
Common Name English
CETYL DIMETHYL BENZYL AMMONIUM BROMIDE
Systematic Name English
HEXADECYLDIMETHYLBENZYLAMMONIUM BROMIDE
Systematic Name English
SINNOQUAT BC 95
Brand Name English
CETYLDIMETHYLBENZYLAMMONIUM BROMIDE
Systematic Name English
NSC-263517
Code English
BENZENEMETHANAMINIUM, N-HEXADECYL-N,N-DIMETHYL-, BROMIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
UHU0390Z3J
Created by admin on Sat Dec 16 04:48:51 UTC 2023 , Edited by admin on Sat Dec 16 04:48:51 UTC 2023
PRIMARY
DRUG BANK
DBSALT001775
Created by admin on Sat Dec 16 04:48:51 UTC 2023 , Edited by admin on Sat Dec 16 04:48:51 UTC 2023
PRIMARY
ECHA (EC/EINECS)
222-556-5
Created by admin on Sat Dec 16 04:48:51 UTC 2023 , Edited by admin on Sat Dec 16 04:48:51 UTC 2023
PRIMARY
EPA CompTox
DTXSID90956729
Created by admin on Sat Dec 16 04:48:51 UTC 2023 , Edited by admin on Sat Dec 16 04:48:51 UTC 2023
PRIMARY
NSC
263517
Created by admin on Sat Dec 16 04:48:51 UTC 2023 , Edited by admin on Sat Dec 16 04:48:51 UTC 2023
PRIMARY
PUBCHEM
165133
Created by admin on Sat Dec 16 04:48:51 UTC 2023 , Edited by admin on Sat Dec 16 04:48:51 UTC 2023
PRIMARY
CAS
3529-04-2
Created by admin on Sat Dec 16 04:48:51 UTC 2023 , Edited by admin on Sat Dec 16 04:48:51 UTC 2023
PRIMARY