Chemical Name - 4-Picolyl Alcohol
Mol Weight - 109.128
Smiles - OCc1ccncc1
Mol Weight - 109.128
Smiles - OCc1ccncc1
| Property Value | |
| Mol Name | 4-Picolyl Alcohol |
| Molweight | 109.128 |
| Monoisotopic Mass | 109.052764 |
| Clogp | 0.0614 |
| Clogs | -0.705 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 92.13 |
| Relative Psa | 0.26126 |
| Polar Surface Area | 33.12 |
| Druglikeness | -1.9045 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.75 |
| Molecular Flexibility | 0.30873 |
| Molecular Complexity | 0.54931 |
| Fragments | 1 |
| Non H Atoms | 8 |
| 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 |
| Symmetric Atoms | 2 |
| Aromatic Nitrogens | 1 |
| Smiles | OCc1ccncc1 |
| InChIKey | InChI=1S/C6H7NO/c8-5-6-1-3-7-4-2-6/h1-4,8H,5H2 |
| InChI | PTMBWNZJOQBTBK-UHFFFAOYSA-N |
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1 - 4-Picolyl Alcohol
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