Pentylboronic Acid
TL;DR: Pentylboronic Acid (CAS 4737-50-2) is a chemical compound with molecular formula C5H13BO2 and molecular weight 116.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentylboronic acid
Also Known As: n-Pentylboronic acid, pentylboronic acid, 1-Pentaneboronic acid, n-Pentylboronicacid, Pentylboronsaure
| Molecular Formula | C5H13BO2 |
|---|---|
| Molecular Weight | 116.10 g/mol |
| LogP | 0.6494 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 116.10086 |
| Heavy Atoms | 8 |
| Complexity | 47.0 |
Chemical Identifiers
| CAS Number | 4737-50-2 |
|---|---|
| SMILES | B(CCCCC)(O)O |
| InChIKey | ABWPXVJNCQKYDR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentylboronic Acid (CAS 4737-50-2), with molecular formula C5H13BO2 and molecular weight 116.10 g/mol. IUPAC: pentylboronic acid.
Chemical Property Profile of Pentylboronic Acid
Property Insights of Pentylboronic Acid
The XLogP value of 0.6494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentylboronic Acid. With a topological polar surface area (TPSA) of 40.5 Ų, Pentylboronic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentylboronic 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 Pentylboronic Acid?
The CAS number of Pentylboronic Acid is 4737-50-2.
What is the molecular formula of Pentylboronic Acid?
The molecular formula of Pentylboronic Acid is C5H13BO2.
What is the molecular weight of Pentylboronic Acid?
The molecular weight of Pentylboronic Acid is 116.10 g/mol.
Where can I buy Pentylboronic Acid?
You can request a quote for Pentylboronic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentylboronic Acid?
Yes, KEHONG BIO provides custom synthesis services for Pentylboronic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.