CAS 4098-71-9 appears in our catalog under these names: Isophorone Diisocyanate, Isophorone diisocyanate, mixture of isomers, 98% , Isophorone diisocyanate, 99.00%, Isophorone Diisocyanate (mixture of isomers), >99.0%(GC), Isophorone diisocyanate, 98+%, mixture of isomers. Offered by: TRC, Dr. Ehrenstorfer, Thermo Scientific (Alfa Aesar), Chemat, TCI. Available pack sizes: 100ml, 10ml, 50ml, 100mg, 5g, 100g, 500g, 25g.
Isophorone diisocyanate is a diisocyanate in which the two isocyanate groups are linked by an isophorone substituent. It is functionally related to an isophorone.
Source: ChEBI
| Molecular formula | C12H18N2O2 |
|---|---|
| Molecular weight | 222.28 g/mol |
| IUPAC name | 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane |
| InChIKey | NIMLQBUJDJZYEJ-UHFFFAOYSA-N |
| SMILES | CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C |
Computed by PubChem (NCBI)