Chemical Name - 2,3-Lutidine1-oxide
Mol Weight - 123.154
Smiles - Cc1ccc[n+]([O-])c1C
Mol Weight - 123.154
Smiles - Cc1ccc[n+]([O-])c1C
| Property Value | |
| Mol Name | 2,3-Lutidine1-oxide |
| Molweight | 123.154 |
| Monoisotopic Mass | 123.068414 |
| Clogp | 0.925 |
| Clogs | -3.917 |
| H Acceptors | 2 |
| Total Surface Area | 99.83 |
| Relative Psa | 0.14284 |
| Polar Surface Area | 25.46 |
| Druglikeness | -4.009 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.55556 |
| Molecular Complexity | 0.74893 |
| Fragments | 1 |
| Non H Atoms | 9 |
| Non Ch Atoms | 2 |
| Electronegative Atoms | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 3 |
| Aromatic Nitrogens | 1 |
| Acidic Oxygens | 1 |
| Smiles | Cc1ccc[n+]([O-])c1C |
| InChIKey | InChI=1S/C7H9NO/c1-6-4-3-5-8(9)7(6)2/h3-5H,1-2H3 |
| InChI | QWLULCKKOHDCIE-UHFFFAOYSA-N |
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1 - 2,3-Lutidine1-oxide
2 - 2,3-Lutidine1-oxide
1 - 2,3-Lutidine1-oxide
2 - 2,3-Lutidine1-oxide
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