Registration Dossier

Reference substances

Reference substances

Currently viewing:

General information

Inventory

No inventory information available

Reference substance information

IUPAC name:
Butanedioic acid, 3-sulfo-, 1-[2-[(1-oxo-dodecyl)amino]ethyl] ester, sodium salt

Molecular and structural information

Molecular formula:
C18H31NNa2O8S
Molecular weight:
ca. 467
SMILES notation:
O=C(OCCNC(CCCCCCCCCCC)=O)CC(S(=O)([O-])=O)C([O-])=O.[Na+].[Na+]
InChl:
InChI=1S/C18H33NO8S.2Na/c1-2-3-4-5-6-7-8-9-10-11-16(20)19-12-13-27-17(21)14-15(18(22)23)28(24,25)26;;/h15H,2-14H2,1H3,(H,19,20)(H,22,23)(H,24,25,26);;/q;2*+1/p-2
Structural formula:
Chemical structure