Chemical Name - 6-Fluoroanthranilonitrile
Mol Weight - 136.129
Smiles - Nc1cccc(F)c1C#N
Mol Weight - 136.129
Smiles - Nc1cccc(F)c1C#N
| Property Value | |
| Mol Name | 6-Fluoroanthranilonitrile |
| Molweight | 136.129 |
| Monoisotopic Mass | 136.043676 |
| Clogp | 0.9187 |
| Clogs | -2.779 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 109.84 |
| Relative Psa | 0.26247 |
| Polar Surface Area | 49.81 |
| Druglikeness | -7.425 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.6 |
| Molecular Complexity | 0.70527 |
| Fragments | 1 |
| Non H Atoms | 10 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Amines | 1 |
| Aromatic Amines | 1 |
| Smiles | Nc1cccc(F)c1C#N |
| InChIKey | InChI=1S/C7H5FN2/c8-6-2-1-3-7(10)5(6)4-9/h1-3H,10H2 |
| InChI | IQUNZGOZUJITBJ-UHFFFAOYSA-N |
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1 - 6-Fluoroanthranilonitrile
2 - 6-Fluoroanthranilonitrile
1 - 6-Fluoroanthranilonitrile
2 - 6-Fluoroanthranilonitrile
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