Dibenzothiophene-2-boronic Acid
TL;DR: Dibenzothiophene-2-boronic Acid (CAS 668983-97-9) is a chemical compound with molecular formula C12H9BO2S and molecular weight 228.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibenzothiophen-2-ylboronic acid
Also Known As: dibenzo[b,d]thiophen-2-ylboronic acid, DIBENZOTHIOPHENE-2-BORONIC ACID, null, Dibenzothiophen-2-ylboronic Acid, Boronic acid, 2-dibenzothienyl-
| Molecular Formula | C12H9BO2S |
|---|---|
| Molecular Weight | 228.04 g/mol |
| LogP | 1.7343 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.04163 |
| Heavy Atoms | 16 |
| Complexity | 660.2271 |
Chemical Identifiers
| CAS Number | 668983-97-9 |
|---|---|
| SMILES | B(C1=CC2=C(C=C1)SC3=CC=CC=C32)(O)O |
Product Overview
Dibenzothiophene-2-boronic Acid (CAS 668983-97-9), with molecular formula C12H9BO2S and molecular weight 228.04 g/mol. IUPAC: dibenzothiophen-2-ylboronic acid.
Chemical Property Profile of Dibenzothiophene-2-boronic Acid
Property Insights of Dibenzothiophene-2-boronic Acid
The XLogP value of 1.7343 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dibenzothiophene-2-boronic Acid. With a topological polar surface area (TPSA) of 40.46 Ų, Dibenzothiophene-2-boronic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzothiophene-2-boronic 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 Dibenzothiophene-2-boronic Acid?
The CAS number of Dibenzothiophene-2-boronic Acid is 668983-97-9.
What is the molecular formula of Dibenzothiophene-2-boronic Acid?
The molecular formula of Dibenzothiophene-2-boronic Acid is C12H9BO2S.
What is the molecular weight of Dibenzothiophene-2-boronic Acid?
The molecular weight of Dibenzothiophene-2-boronic Acid is 228.04 g/mol.
Where can I buy Dibenzothiophene-2-boronic Acid?
You can request a quote for Dibenzothiophene-2-boronic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzothiophene-2-boronic Acid?
Yes, KEHONG BIO provides custom synthesis services for Dibenzothiophene-2-boronic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.