4-Azidophenylisothiocyanate
1-azido-4-isothiocyanatobenzene
Also Known As: 4-Azidophenyl isothiocyanate|1-azido-4-isothiocyanatobenzene|4-Azidophenylisothiocyanate|N3PhNCS|para-Azidophenyl isothiocyanate|p-azidophenylisothiocyanate|ACMC-1BFD7|Benzene, 1-azido-4-isothiocyanato-|Benzene,1-azido-4-isothiocyanato-|I01-17094
CAS: 74261-65-7
| Molecular Formula | C7H4N4S |
|---|---|
| Molecular Weight | 176.01567 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 58.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.01567 |
| Monoisotopic Mass | 176.01567 |
| Heavy Atoms | 12 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 74261-65-7 |
|---|---|
| SMILES | C1=CC(=CC=C1N=C=S)N=[N+]=[N-] |
| InChIKey | XMPGXADJZXSISQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Polymer Intermediates (1 patents)
Product Overview
4-Azidophenylisothiocyanate (CAS 74261-65-7), with molecular formula C7H4N4S and molecular weight 176.01567 g/mol. IUPAC: 1-azido-4-isothiocyanatobenzene.
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.
View MSDS →
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