Chemical Name - Ortho Anisidine
Mol Weight - 123.154
Smiles - COc(cccc1)c1N
Mol Weight - 123.154
Smiles - COc(cccc1)c1N
| Property Value | |
| Mol Name | Ortho Anisidine |
| Molweight | 123.154 |
| Monoisotopic Mass | 123.068414 |
| Clogp | 0.9123 |
| Clogs | -1.71 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 104.04 |
| Relative Psa | 0.24289 |
| Polar Surface Area | 35.25 |
| Druglikeness | -1.7412 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.66667 |
| Molecular Flexibility | 0.28257 |
| Molecular Complexity | 0.69315 |
| Fragments | 1 |
| Non H Atoms | 9 |
| Non Ch Atoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bonds | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 2 |
| Amines | 1 |
| Aromatic Amines | 1 |
| Smiles | COc(cccc1)c1N |
| InChIKey | InChI=1S/C7H9NO/c1-9-7-5-3-2-4-6(7)8/h2-5H,8H2,1H3 |
| InChI | VMPITZXILSNTON-UHFFFAOYSA-N |
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1 - Ortho Anisidine
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2 - Ortho Anisidine
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