| MolName | 4,4,5,5-tetramethyl-2-[(E)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-1-en-2-yl]-1,3,2-dioxaborolane |
| MolecularFormula | C19H36O4B2 |
| Smiles | CCCCC/C(/B1OC(C)(C)C(C)(C)O1)=C/B1OC(C)(C)C(C)(C)O1 |
| InChI | InChI=1S/C19H36B2O4/c1-10-11-12-13-15(21-24-18(6,7)19(8,9)25-21)14-20-22-16(2,3)17(4,5)23-20/h14H,10-13H2,1-9H3 |
| InChIK | KBMWLQPDFRGVTD-UHFFFAOYSA-N |
| TotalMolweight | 350.113 |
| Molweight | 350.113 |
| MonoisotopicMass | 350.27997 |
| CLogP | 3.7118 |
| CLogS | -1.329 |
| H Acceptors | 4 |
| TotalSurfaceArea | 287.43 |
| Relative PSA | 0.13916 |
| PolarSurfaceArea | 36.92 |
| Druglikeness | -30.733 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | unwanted atom |
| Shape Index | 0.44 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Sp3Atoms | 21 |
| Symmetricatoms | 10 |
| StereoCon |
Click to Load Molecule:
1 - 4,4,5,5-tetramethyl-2-[(E)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-1-en-2-yl]-1,3,2-dioxaborolane | 2 - 4,4,5,5-tetramethyl-2-[(E)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-1-en-2-yl]-1,3,2-dioxaborolane