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Reference substances

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IUPAC name:
2-({[3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl]carbamoyl}oxy)ethyl prop-2-enoate

Inventory

CAS number:
124451-79-2
Synonyms
Names:
Monoadduct of isophorone diisocyanate with 2-hydroxyethyl acrylate (reaction of ring located isocyanate function)

Molecular and structural information

Molecular formula:
C17H26N2O5
Molecular weight:
338.41
SMILES notation:
O=C=NCC1(C)CC(C)(C)CC(C1)NC(=O)OCCOC(=O)C=C
InChl:
InChI=1S/C17H26N2O5/c1-5-14(21)23-6-7-24-15(22)19-13-8-16(2,3)10-17(4,9-13)11-18-12-20/h5,13H,1,6-11H2,2-4H3,(H,19,22)
Structural formula:
Chemical structure

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