3-phenylpropylboronic Acid
TL;DR: 3-phenylpropylboronic Acid (CAS 36329-85-8) is a chemical compound with molecular formula C9H13BO2 and molecular weight 164.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylpropylboronic acid
Also Known As: (3-Phenylpropyl)boronic acid, 3-phenylpropylboronic Acid, (3-Phenylpropyl)boronicacid, 3-Phenylpropyl boronic acid, (3-Phenylpropyl)dihydroxyborane
| Molecular Formula | C9H13BO2 |
|---|---|
| Molecular Weight | 164.10 g/mol |
| LogP | 1.092 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 164.10086 |
| Heavy Atoms | 12 |
| Complexity | 211.02834 |
Chemical Identifiers
| CAS Number | 36329-85-8 |
|---|---|
| SMILES | B(CCCC1=CC=CC=C1)(O)O |
Product Overview
3-phenylpropylboronic Acid (CAS 36329-85-8), with molecular formula C9H13BO2 and molecular weight 164.10 g/mol. IUPAC: 3-phenylpropylboronic acid.
Chemical Property Profile of 3-phenylpropylboronic Acid
Property Insights of 3-phenylpropylboronic Acid
The XLogP value of 1.092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-phenylpropylboronic Acid. With a topological polar surface area (TPSA) of 40.46 Ų, 3-phenylpropylboronic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-phenylpropylboronic 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 3-phenylpropylboronic Acid?
The CAS number of 3-phenylpropylboronic Acid is 36329-85-8.
What is the molecular formula of 3-phenylpropylboronic Acid?
The molecular formula of 3-phenylpropylboronic Acid is C9H13BO2.
What is the molecular weight of 3-phenylpropylboronic Acid?
The molecular weight of 3-phenylpropylboronic Acid is 164.10 g/mol.
Where can I buy 3-phenylpropylboronic Acid?
You can request a quote for 3-phenylpropylboronic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-phenylpropylboronic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-phenylpropylboronic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.