Tert-butylboronic acid
TL;DR: Tert-butylboronic acid (CAS 86253-12-5) is a chemical compound with molecular formula C4H11BO2 and molecular weight 102.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butylboronic acid
Also Known As: Tert-butylboronic Acid, tert-butylboranediol, Tert-butylboronicacid, t-butylboronic acid, Boronic acid, (1,1-dimethylethyl)-
| Molecular Formula | C4H11BO2 |
|---|---|
| Molecular Weight | 102.09 g/mol |
| LogP | 0.2593 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 102.08521 |
| Heavy Atoms | 7 |
| Complexity | 55.20036 |
Chemical Identifiers
| CAS Number | 86253-12-5 |
|---|---|
| SMILES | B(C(C)(C)C)(O)O |
Product Overview
Tert-butylboronic acid (CAS 86253-12-5), with molecular formula C4H11BO2 and molecular weight 102.09 g/mol. IUPAC: tert-butylboronic acid.
Chemical Property Profile of Tert-butylboronic acid
Property Insights of Tert-butylboronic acid
The XLogP value of 0.2593 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butylboronic acid. With a topological polar surface area (TPSA) of 40.46 Ų, Tert-butylboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tert-butylboronic acid has 2 hydrogen bond donor(s) and 2 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 Tert-butylboronic acid?
The CAS number of Tert-butylboronic acid is 86253-12-5.
What is the molecular formula of Tert-butylboronic acid?
The molecular formula of Tert-butylboronic acid is C4H11BO2.
What is the molecular weight of Tert-butylboronic acid?
The molecular weight of Tert-butylboronic acid is 102.09 g/mol.
Where can I buy Tert-butylboronic acid?
You can request a quote for Tert-butylboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butylboronic acid?
Yes, KEHONG BIO provides custom synthesis services for Tert-butylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.