Chemical Name - 4-methoxybenzaldehydeoxime
Mol Weight - 151.164
Smiles - COc1ccc(C=NO)cc1
Mol Weight - 151.164
Smiles - COc1ccc(C=NO)cc1
| Property Value | |
| Mol Name | 4-methoxybenzaldehydeoxime |
| Molweight | 151.164 |
| Monoisotopic Mass | 151.063329 |
| Clogp | 2.1443 |
| Clogs | -2.333 |
| H Acceptors | 3 |
| H Donors | 1 |
| Total Surface Area | 126.63 |
| Relative Psa | 0.27332 |
| Polar Surface Area | 41.82 |
| Druglikeness | -0.86623 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.81818 |
| Molecular Flexibility | 0.42045 |
| Molecular Complexity | 0.6089 |
| Fragments | 1 |
| Non H Atoms | 11 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bonds | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 3 |
| Symmetric Atoms | 2 |
| Smiles | COc1ccc(C=NO)cc1 |
| InChIKey | InChI=1S/C8H9NO2/c1-11-8-4-2-7(3-5-8)6-9-10/h2-6,10H,1H3 |
| InChI | FXOSHPAYNZBSFO-UHFFFAOYSA-N |
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1 - 4-methoxybenzaldehydeoxime
2 - 4-methoxybenzaldehydeoxime
1 - 4-methoxybenzaldehydeoxime
2 - 4-methoxybenzaldehydeoxime
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