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Details

Stereochemistry RACEMIC
Molecular Formula C20H44NO2
Molecular Weight 330.5689
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of HYDROXYCETYL HYDROXYETHYL DIMONIUM

SMILES

CCCCCCCCCCCCCCC(O)C[N+](C)(C)CCO

InChI

InChIKey=SKHXKLYFBLSNDZ-UHFFFAOYSA-N
InChI=1S/C20H44NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20(23)19-21(2,3)17-18-22/h20,22-23H,4-19H2,1-3H3/q+1

HIDE SMILES / InChI

Molecular Formula C20H43NO2
Molecular Weight 329.5609
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 02:16:14 GMT 2023
Edited
by admin
on Sat Dec 16 02:16:14 GMT 2023
Record UNII
07MLW3BNP0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDROXYCETYL HYDROXYETHYL DIMONIUM
Common Name English
1-HEXADECANAMINIUM, 2-HYDROXY-N-(2-HYDROXYETHYL)-N,N-DIMETHYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
3020020
Created by admin on Sat Dec 16 02:16:14 GMT 2023 , Edited by admin on Sat Dec 16 02:16:14 GMT 2023
PRIMARY
CAS
85006-12-8
Created by admin on Sat Dec 16 02:16:14 GMT 2023 , Edited by admin on Sat Dec 16 02:16:14 GMT 2023
PRIMARY
FDA UNII
07MLW3BNP0
Created by admin on Sat Dec 16 02:16:14 GMT 2023 , Edited by admin on Sat Dec 16 02:16:14 GMT 2023
PRIMARY
Related Record Type Details
IONIC MOIETY
SALT/SOLVATE -> PARENT