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Details

Stereochemistry ACHIRAL
Molecular Formula C17H28Cl2NO
Molecular Weight 333.316
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of CHLORPHENOCTIUM

SMILES

CCCCCCCC[N+](C)(C)COC1=CC=C(Cl)C=C1Cl

InChI

InChIKey=MPFGBTBBXXRJCD-UHFFFAOYSA-N
InChI=1S/C17H28Cl2NO/c1-4-5-6-7-8-9-12-20(2,3)14-21-17-11-10-15(18)13-16(17)19/h10-11,13H,4-9,12,14H2,1-3H3/q+1

HIDE SMILES / InChI

Molecular Formula C17H28Cl2NO
Molecular Weight 333.316
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:49:15 GMT 2023
Edited
by admin
on Fri Dec 15 15:49:15 GMT 2023
Record UNII
DO4NM1D8UU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CHLORPHENOCTIUM
Common Name English
1-OCTANAMINIUM, N-((2,4-DICHLOROPHENOXY)METHYL)-N,N-DIMETHYL-
Systematic Name English
CHLORPHENOCTIUM CATION
Common Name English
CHLORPHENOCTIUM ION
Common Name English
((2,4-DICHLOROPHENOXY)METHYL)DIMETHYL-N-OCTYLAMMONIUM
Systematic Name English
Code System Code Type Description
FDA UNII
DO4NM1D8UU
Created by admin on Fri Dec 15 15:49:15 GMT 2023 , Edited by admin on Fri Dec 15 15:49:15 GMT 2023
PRIMARY
CAS
47166-61-0
Created by admin on Fri Dec 15 15:49:15 GMT 2023 , Edited by admin on Fri Dec 15 15:49:15 GMT 2023
PRIMARY
PUBCHEM
71848
Created by admin on Fri Dec 15 15:49:15 GMT 2023 , Edited by admin on Fri Dec 15 15:49:15 GMT 2023
PRIMARY
EPA CompTox
DTXSID90197054
Created by admin on Fri Dec 15 15:49:15 GMT 2023 , Edited by admin on Fri Dec 15 15:49:15 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY