U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C30H63N2O3.Cl
Molecular Weight 535.286
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BEHENAMIDOPROPYL PROPYLENE GLYCOL-DIMONIUM CHLORIDE

SMILES

[Cl-].CCCCCCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(O)CO

InChI

InChIKey=XJMNWALRJHPRBS-UHFFFAOYSA-N
InChI=1S/C30H62N2O3.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-30(35)31-25-23-26-32(2,3)27-29(34)28-33;/h29,33-34H,4-28H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C30H62N2O3
Molecular Weight 498.8249
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:49:51 GMT 2023
Edited
by admin
on Sat Dec 16 01:49:51 GMT 2023
Record UNII
CBP4998C8Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BEHENAMIDOPROPYL PROPYLENE GLYCOL-DIMONIUM CHLORIDE
Common Name English
2,3-DIHYDROXYPROPYLDIMETHYLAMINOPROPYL BEHENAMIDE CHLORIDE
Systematic Name English
BEHENAMIDOPROPYL PG-DIMONIUM CHLORIDE
INCI  
INCI  
Official Name English
LEXQUAT AMG-BEO
Brand Name English
BEHENAMIDOPROPYL PG-DIMONIUM CHLORIDE [INCI]
Common Name English
(±)-BEHENAMIDOPROPYL PG-DIMONIUM CHLORIDE
Common Name English
BEHENAMIDOPROPYL PG-DIMONIUM CHLORIDE, (±)-
Common Name English
AEC BEHENAMIDOPROPYL PG-DIMONIUM CHLORIDE
Brand Name English
1-PROPANAMINIUM, 2,3-DIHYDROXY-N,N-DIMETHYL-N-(3-((1-OXODOCOSYL)AMINO)PROPYL)-, CHLORIDE
Systematic Name English
1-PROPANAMINIUM, 2,3-DIHYDROXY-N,N-DIMETHYL-N-(3-((1-OXODOCOSYL)AMINO)PROPYL)-, CHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
49785643
Created by admin on Sat Dec 16 01:49:51 GMT 2023 , Edited by admin on Sat Dec 16 01:49:51 GMT 2023
PRIMARY
FDA UNII
CBP4998C8Q
Created by admin on Sat Dec 16 01:49:51 GMT 2023 , Edited by admin on Sat Dec 16 01:49:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID20929582
Created by admin on Sat Dec 16 01:49:51 GMT 2023 , Edited by admin on Sat Dec 16 01:49:51 GMT 2023
PRIMARY
CAS
136920-10-0
Created by admin on Sat Dec 16 01:49:51 GMT 2023 , Edited by admin on Sat Dec 16 01:49:51 GMT 2023
PRIMARY