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

Details

Stereochemistry ACHIRAL
Molecular Formula C25H40N.Cl
Molecular Weight 390.045
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIMETHYLDODECYL(1-NAPHTHYLMETHYL)AMMONIUM CHLORIDE

SMILES

[Cl-].CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC2=CC=CC=C12

InChI

InChIKey=UTKUXSTWKJCLJX-UHFFFAOYSA-M
InChI=1S/C25H40N.ClH/c1-4-5-6-7-8-9-10-11-12-15-21-26(2,3)22-24-19-16-18-23-17-13-14-20-25(23)24;/h13-14,16-20H,4-12,15,21-22H2,1-3H3;1H/q+1;/p-1

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 C25H40N
Molecular Weight 354.5918
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:59:21 GMT 2023
Edited
by admin
on Fri Dec 15 17:59:21 GMT 2023
Record UNII
2ZIC77S19B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIMETHYLDODECYL(1-NAPHTHYLMETHYL)AMMONIUM CHLORIDE
Systematic Name English
DODECYLDIMETHYL(1-NAPHTHYLMETHYL)AMMONIUM CHLORIDE
Systematic Name English
LAURYLDIMETHYL(1-NAPHTHYLMETHYL)AMMONIUM CHLORIDE
Systematic Name English
AMMONIUM, DODECYLDIMETHYL(1-NAPHTHYLMETHYL)-, CHLORIDE
Systematic Name English
1-NAPHTHALENEMETHANAMINIUM, N-DODECYL-N,N-DIMETHYL-, CHLORIDE
Systematic Name English
1-NAPHTHALENEMETHANAMINIUM, N-DODECYL-N,N-DIMETHYL-, CHLORIDE (1:1)
Systematic Name English
DIMETHYLDODECYL(.ALPHA.-NAPHTHYLMETHYL)AMMONIUM CHLORIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
61271
Created by admin on Fri Dec 15 17:59:21 GMT 2023 , Edited by admin on Fri Dec 15 17:59:21 GMT 2023
PRIMARY
DAILYMED
2ZIC77S19B
Created by admin on Fri Dec 15 17:59:21 GMT 2023 , Edited by admin on Fri Dec 15 17:59:21 GMT 2023
PRIMARY
CAS
1733-96-6
Created by admin on Fri Dec 15 17:59:21 GMT 2023 , Edited by admin on Fri Dec 15 17:59:21 GMT 2023
PRIMARY
ECHA (EC/EINECS)
217-074-7
Created by admin on Fri Dec 15 17:59:21 GMT 2023 , Edited by admin on Fri Dec 15 17:59:21 GMT 2023
PRIMARY
EPA CompTox
DTXSID20938351
Created by admin on Fri Dec 15 17:59:21 GMT 2023 , Edited by admin on Fri Dec 15 17:59:21 GMT 2023
PRIMARY
FDA UNII
2ZIC77S19B
Created by admin on Fri Dec 15 17:59:21 GMT 2023 , Edited by admin on Fri Dec 15 17:59:21 GMT 2023
PRIMARY