Naphtho[2,3-d][1,3]dioxole-6-carbonitrile
benzo[f][1,3]benzodioxole-6-carbonitrile
Also Known As: Naphtho[2,3-d][1,3]dioxole-6-carbonitrile|benzo[f][1,3]benzodioxole-6-carbonitrile|4252AE|2H-naphtho[2,3-d][1,3]dioxole-6-carbonitrile|NCI60_005830|J1.926.047J|Naphtho[2,3-d]-1,3-dioxole-6-carbonitrile|2H-naphtho[2,3-d]1,3-dioxolene-6-carbonitrile|I14-30743
CAS: 4943-58-2
| Molecular Formula | C12H7NO2 |
|---|---|
| Molecular Weight | 197.04768 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 42.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 197.04768 |
| Monoisotopic Mass | 197.04768 |
| Heavy Atoms | 15 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 4943-58-2 |
|---|---|
| SMILES | C1OC2=C(O1)C=C3C=C(C=CC3=C2)C#N |
| InChIKey | IKDFUPGVIMSEPZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (2 patents)
Product Overview
Naphtho[2,3-d][1,3]dioxole-6-carbonitrile (CAS 4943-58-2), with molecular formula C12H7NO2 and molecular weight 197.04768 g/mol. IUPAC: benzo[f][1,3]benzodioxole-6-carbonitrile.
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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