3-Chloro-4-methoxybenzeneboronic acid
TL;DR: 3-Chloro-4-methoxybenzeneboronic acid (CAS 175883-60-0) is a chemical compound with molecular formula C7H8BClO3 and molecular weight 186.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloro-4-methoxyphenyl)boronic acid
Also Known As: 3-Chloro-4-methoxyphenylboronic acid, (3-chloro-4-methoxyphenyl)boronic acid, 4-Borono-2-chloroanisole, 3-Chloro-4-methoxybenzeneboronic acid, akos brn-0653
| Molecular Formula | C7H8BClO3 |
|---|---|
| Molecular Weight | 186.03 g/mol |
| LogP | 0.0284 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.0255 |
| Heavy Atoms | 12 |
| Complexity | 277.35403 |
Chemical Identifiers
| CAS Number | 175883-60-0 |
|---|---|
| SMILES | B(C1=CC(=C(C=C1)OC)Cl)(O)O |
Product Overview
3-Chloro-4-methoxybenzeneboronic acid (CAS 175883-60-0), with molecular formula C7H8BClO3 and molecular weight 186.03 g/mol. IUPAC: (3-chloro-4-methoxyphenyl)boronic acid.
Chemical Property Profile of 3-Chloro-4-methoxybenzeneboronic acid
Property Insights of 3-Chloro-4-methoxybenzeneboronic acid
The XLogP value of 0.0284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-4-methoxybenzeneboronic acid. With a topological polar surface area (TPSA) of 49.69 Ų, 3-Chloro-4-methoxybenzeneboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-4-methoxybenzeneboronic 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
Frequently Asked Questions
What is the CAS number of 3-Chloro-4-methoxybenzeneboronic acid?
The CAS number of 3-Chloro-4-methoxybenzeneboronic acid is 175883-60-0.
What is the molecular formula of 3-Chloro-4-methoxybenzeneboronic acid?
The molecular formula of 3-Chloro-4-methoxybenzeneboronic acid is C7H8BClO3.
What is the molecular weight of 3-Chloro-4-methoxybenzeneboronic acid?
The molecular weight of 3-Chloro-4-methoxybenzeneboronic acid is 186.03 g/mol.
Where can I buy 3-Chloro-4-methoxybenzeneboronic acid?
You can request a quote for 3-Chloro-4-methoxybenzeneboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-4-methoxybenzeneboronic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-4-methoxybenzeneboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.