3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid
TL;DR: 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid (CAS 159613-21-5) is a chemical compound with molecular formula C12H17BO4 and molecular weight 236.122 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-cyclopentyloxy-4-methoxyphenyl)boronic acid
Also Known As: (3-(Cyclopentyloxy)-4-methoxyphenyl)boronic acid, 3-(Cyclopentyloxy)-4-methoxyphenylboronic acid, QUININEHYDROBROMIDE, (3-cyclopentyloxy-4-methoxyphenyl)boronic acid, AKOS BRN-0166
Technical Specifications
| Molecular Formula | C12H17BO4 |
| Molecular Weight | 236.122 g/mol |
| XLogP | 0.6964 |
| Topological Polar Surface Area (TPSA) | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.122 Da |
| Heavy Atoms | 17 |
| Complexity | 231.0 |
| SMILES | B(C1=CC(=C(C=C1)OC)OC2CCCC2)(O)O |
| InChIKey | PTXMXVNPZGJCAA-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid
Property Insights of 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid
The XLogP value of 0.6964 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid. With a topological polar surface area (TPSA) of 58.9 Ų, 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid?
The CAS number of 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid is 159613-21-5.
What is the molecular formula of 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid?
The molecular formula of 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid is C12H17BO4.
What is the molecular weight of 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid?
The molecular weight of 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid is 236.122 g/mol.
Where can I buy 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid?
You can request a quote for 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid?
Yes, CoreyChem provides custom synthesis services for 3-(Cyclopentyloxy)-4-methoxybenzeneboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.