TL;DR: 3-Vinylphenylboronic Acid (contains varying amounts of Anhydride) (CAS 15016-43-0) is a chemical compound with molecular formula C8H9BO2 and molecular weight 148.06956 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-ethenylphenyl)boronic acid
Also Known As: 3-Vinylphenylboronic acid, (3-Vinylphenyl)boronic acid, 3-Vinylbenzeneboronic acid, (3-ethenylphenyl)boronic Acid, 3-Vinylphenylbronicacid
| Molecular Formula | C8H9BO2 |
| Molecular Weight | 148.06956 g/mol |
| XLogP | 0.0094 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 148.06956 Da |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
| SMILES | B(C1=CC(=CC=C1)C=C)(O)O |
| InChIKey | SYBQEKBVWDPVJM-UHFFFAOYSA-N |
The XLogP value of 0.0094 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Vinylphenylboronic Acid (contains varying amounts of Anhydride). With a topological polar surface area (TPSA) of 40.5 Ų, 3-Vinylphenylboronic Acid (contains varying amounts of Anhydride) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Vinylphenylboronic Acid (contains varying amounts of Anhydride) has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Vinylphenylboronic Acid (contains varying amounts of Anhydride) is 15016-43-0.
The molecular formula of 3-Vinylphenylboronic Acid (contains varying amounts of Anhydride) is C8H9BO2.
The molecular weight of 3-Vinylphenylboronic Acid (contains varying amounts of Anhydride) is 148.06956 g/mol.
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