Chemical Name - Cyclopentyl Boronic Acid
Mol Weight - 113.951
Smiles - OB(C1CCCC1)O
Mol Weight - 113.951
Smiles - OB(C1CCCC1)O
| Property Value | |
| Mol Name | Cyclopentyl Boronic Acid |
| Molweight | 113.951 |
| Monoisotopic Mass | 114.08521 |
| Clogp | 1.368 |
| Clogs | 0.93 |
| H Acceptors | 2 |
| H Donors | 2 |
| Total Surface Area | 94.84 |
| Relative Psa | 0.27625 |
| Polar Surface Area | 40.46 |
| Druglikeness | -14.756 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.625 |
| Molecular Flexibility | 0.52406 |
| Molecular Complexity | 0.59947 |
| Fragments | 1 |
| Non H Atoms | 8 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 2 |
| Rotatable Bonds | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3 Atoms | 7 |
| Symmetric Atoms | 3 |
| Smiles | OB(C1CCCC1)O |
| InChIKey | InChI=1S/C5H11BO2/c7-6(8)5-3-1-2-4-5/h5,7-8H,1-4H2 |
| InChI | VTTDFSNKIMAQTB-UHFFFAOYSA-N |
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