2,4-Dimethylphenylisocyanide
1-isocyano-2,4-dimethylbenzene
Also Known As: 1-isocyano-2,4-dimethylbenzene|2,4-dimethylphenylisocyanide|2,4-dimethylphenylisonitrile|1-isocyano-2,4-dimethyl-benzene|Benzene,1-isocyano-2,4-dimethyl-|[(2,4-Dimethylphenyl)imino]carbene|GS3828|2,4-DIMETHYLPHENYL ISOCYANIDE|[(2,4-dimethylphenyl)imino]methylidene|Benzene, 1-isocyano-2,4-dimethyl- (9CI)|J1.626.746E|J2.117.265K
CAS: 3100-93-4
| Molecular Formula | C9H9N |
|---|---|
| Molecular Weight | 131.0735 g/mol |
| LogP | 2.85423 |
| Topological Polar Surface Area | 4.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 131.0735 |
| Monoisotopic Mass | 131.0735 |
| Heavy Atoms | 10 |
| Complexity | 281.27002 |
Chemical Identifiers
| CAS Number | 3100-93-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)[N+]#[C-])C |
Product Overview
2,4-Dimethylphenylisocyanide (CAS 3100-93-4), with molecular formula C9H9N and molecular weight 131.0735 g/mol. IUPAC: 1-isocyano-2,4-dimethylbenzene.
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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