Registration Dossier

Reference substances

Reference substances

Currently viewing:

General information

Inventory

EC number:
221-108-6
EC name:
Dodecylethyldimethylammonium ethyl sulphate
CAS number:
3006-13-1

No inventory information available

Reference substance information

IUPAC name:
dodecylethyldimethylammonium ethyl sulphate
Synonyms
Names:
1-Dodecanaminium, N-ethyl-N,N-dimethyl-, ethyl sulfate
Identifier:
IUPAC name
N-ethyl-N,N-dimethyldodecan-1-aminium ethyl sulfate
Identifier:
other: InChl
InChI=1/C16H36N.C2H6O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17(3,4)6-2;1-2-6-7(3,4)5/h5-16H2,1-4H3;2H2,1H3,(H,3,4,5)/q+1;/p-1

CAS information

CAS number:
3006-13-1

Molecular and structural information

Molecular formula:
C16H36N.C2H5O4S
Molecular weight:
367
SMILES notation:
CCCCCCCCCCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]
InChl:
InChI=1S/C16H36N.C2H6O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17(3,4)6-2;1-2-6-7(3,4)5/h5-16H2,1-4H3;2H2,1H3,(H,3,4,5)/q+1;/p-1
Structural formula:
Chemical structure