3-Fluoro-4-methoxyphenylacetonitrile
2-(3-fluoro-4-methoxyphenyl)acetonitrile
Also Known As: 3-Fluoro-4-methoxyphenylacetonitrile|3-Fluoro-4-methoxylphenylacetonitrile|3-Fluoro-4-methoxybenzyl cyanide|2-(3-fluoro-4-methoxyphenyl)acetonitrile|3-Fluoro-4-methoxybenzylcyanide|ACMC-1AHK8|(3-fluoro-4-methoxyphenyl)acetonitrile|3-Fluoro-4-methoxylacetonitrile|KS-00000EIE|4-(Cyanomethyl)-2-fluoroanisole|OTAVA-BB 1780049|Benzeneacetonitrile, 3-fluoro-4-methoxy-|ACN-S004027|WT1763|3-Fluoro-4-methoxybenzeneacetonitrile|2-(3-fluoro-4-methoxy-phenyl)acetonitrile|CS-W021918|FS-1544
| Molecular Formula | C9H8FNO |
|---|---|
| Molecular Weight | 165.05899 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.05899 |
| Monoisotopic Mass | 165.05899 |
| Heavy Atoms | 12 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 404-90-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC#N)F |
| InChIKey | OFCMGCZEFVKTAN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Fluoro-4-methoxyphenylacetonitrile (CAS 404-90-0), with molecular formula C9H8FNO and molecular weight 165.05899 g/mol. IUPAC: 2-(3-fluoro-4-methoxyphenyl)acetonitrile.