Registration Dossier

Reference substances

Reference substances

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General information

Inventory

No inventory information available

Reference substance information

IUPAC name:
3,5-Bis{6-[5-(6-isocyanatohexyl)-2,4,6-trioxo-1,3,5-oxadiazin-3-yl]hexyl}-1,3,5-oxadiazine-2,4,6-trione

Molecular and structural information

Molecular formula:
C35H48N8O14
Molecular weight:
ca. 804.8
SMILES notation:
N1(CCCCCCN(C(=O)OC2=O)C(=O)N2CCCCCCN(C(=O)N(CCCCCCN=C=O)C2=O)C(O2)=O)C(=O)OC(N(C1=O)CCCCCCN=C=O)=O
InChl:
InChI=1S/C35H48N8O14/c44-25-36-17-9-1-3-11-19-38-27(46)40(32(51)55-30(38)49)21-13-5-7-15-23-42-29(48)43(35(54)57-34(42)53)24-16-8-6-14-22-41-28(47)39(31(50)56-33(41)52)20-12-4-2-10-18-37-26-45/h1-24H2
Structural formula:
Chemical structure