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Reference substances

Reference substances

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General information

Inventory

No inventory information available

Reference substance information

IUPAC name:
2-Ethylhexyl-2-[3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl]-4-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]ureaoate

Molecular and structural information

Molecular formula:
C32H54N4O5
Molecular weight:
ca. 574.8
SMILES notation:
C1(C)(CN=C=O)CC(CC(C)(C1)C)N(C(=O)NCC(C)(CC(C)(C1)C)CC1N=C=O)C(=O)OCC(CC)CCCC
InChl:
InChI=1S/C32H54N4O5/c1-9-11-12-24(10-2)17-41-28(40)36(26-15-30(5,6)19-32(8,16-26)20-33-22-37)27(39)34-21-31(7)14-25(35-23-38)13-29(3,4)18-31/h24-26H,9-21H2,1-8H3,(H,34,39)
Structural formula:
Chemical structure