Registration Dossier

Reference substances

Reference substances

Currently viewing:

General information

Inventory

No inventory information available

Reference substance information

IUPAC name:
N-(3-ammoniopropyl)-N'-{3-[(9Z)-octadec-9-en-1-ylammonio]propyl}propane-1,3-diaminium tetraacetate

Molecular and structural information

Molecular formula:
C35H74N4O8
Molecular weight:
ca. 679
SMILES notation:
O=C([O-])C.[O-]C(C)=O.CCCCCCCC\C=C/CCCCCCCC[NH2+]CCC[NH2+]CCC[NH2+]CCC[NH3+].[O-]C(C)=O.[O-]C(C)=O
InChl:
InChI=1/C27H58N4.4C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-29-24-19-26-31-27-20-25-30-23-18-21-28;4*1-2(3)4/h9-10,29-31H,2-8,11-28H2,1H3;4*1H3,(H,3,4)/b10-9-;;;;
Structural formula:
Chemical structure