4-(Benzyloxy)-3,5-dichlorophenylboronic acid
TL;DR: 4-(Benzyloxy)-3,5-dichlorophenylboronic acid (CAS 1218790-59-0) is a chemical compound with molecular formula C13H11BCl2O3 and molecular weight 296.01782 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,5-dichloro-4-phenylmethoxyphenyl)boronic acid
Also Known As: 4-(Benzyloxy)-3,5-dichlorophenylboronic acid, 4-Benzyloxy-3,5-dichlorophenylboronic acid, (4-(Benzyloxy)-3,5-dichlorophenyl)boronic acid, 4-Benzyloxy-3,5-dichlorobenzeneboronic acid, (3,5-dichloro-4-phenylmethoxyphenyl)boronic acid
Technical Specifications
| Molecular Formula | C13H11BCl2O3 |
| Molecular Weight | 296.01782 g/mol |
| XLogP | 2.2522 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.01782 Da |
| Heavy Atoms | 19 |
| Complexity | 263.0 |
| SMILES | B(C1=CC(=C(C(=C1)Cl)OCC2=CC=CC=C2)Cl)(O)O |
| InChIKey | BAXPPGSWZDNMOG-UHFFFAOYSA-N |
Chemical Property Profile of 4-(Benzyloxy)-3,5-dichlorophenylboronic acid
Property Insights of 4-(Benzyloxy)-3,5-dichlorophenylboronic acid
The XLogP value of 2.2522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Benzyloxy)-3,5-dichlorophenylboronic acid. With a topological polar surface area (TPSA) of 49.7 Ų, 4-(Benzyloxy)-3,5-dichlorophenylboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Benzyloxy)-3,5-dichlorophenylboronic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(Benzyloxy)-3,5-dichlorophenylboronic acid?
The CAS number of 4-(Benzyloxy)-3,5-dichlorophenylboronic acid is 1218790-59-0.
What is the molecular formula of 4-(Benzyloxy)-3,5-dichlorophenylboronic acid?
The molecular formula of 4-(Benzyloxy)-3,5-dichlorophenylboronic acid is C13H11BCl2O3.
What is the molecular weight of 4-(Benzyloxy)-3,5-dichlorophenylboronic acid?
The molecular weight of 4-(Benzyloxy)-3,5-dichlorophenylboronic acid is 296.01782 g/mol.
Where can I buy 4-(Benzyloxy)-3,5-dichlorophenylboronic acid?
You can request a quote for 4-(Benzyloxy)-3,5-dichlorophenylboronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Benzyloxy)-3,5-dichlorophenylboronic acid?
Yes, CoreyChem provides custom synthesis services for 4-(Benzyloxy)-3,5-dichlorophenylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.