3-(p-Isocyanatobenzyl)-o-tolyl isocyanate
1-isocyanato-3-[(4-isocyanatophenyl)methyl]-2-methylbenzene
Also Known As: EINECS 278-827-3|3-(p-Isocyanatobenzyl)-o-tolyl isocyanate|1-isocyanato-3-[(4-isocyanatophenyl)methyl]-2-methylbenzene|1-Isocyanato-3-(4-isocyanatobenzyl)-2-methylbenzene|2-isocyanato-1-[(4-isocyanatophenyl)methyl]-3-methylbenzene
CAS: 78084-30-7
| Molecular Formula | C16H12N2O2 |
|---|---|
| Molecular Weight | 264.08987 g/mol |
| LogP | 3.52042 |
| Topological Polar Surface Area | 58.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.08987 |
| Monoisotopic Mass | 264.08987 |
| Heavy Atoms | 20 |
| Complexity | 707.7568 |
Chemical Identifiers
| CAS Number | 78084-30-7 |
|---|---|
| SMILES | CC1=C(C=CC=C1N=C=O)CC2=CC=C(C=C2)N=C=O |
Product Overview
3-(p-Isocyanatobenzyl)-o-tolyl isocyanate (CAS 78084-30-7), with molecular formula C16H12N2O2 and molecular weight 264.08987 g/mol. IUPAC: 1-isocyanato-3-[(4-isocyanatophenyl)methyl]-2-methylbenzene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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