Prop-1-enylboronic acid
TL;DR: Prop-1-enylboronic acid (CAS 6336-44-3) is a chemical compound with molecular formula C3H7BO2 and molecular weight 86.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-1-enylboronic acid
Also Known As: cis-Propenylboronic acid, prop-1-enylboronic acid, propenyl boronic acid, trans-1-Propen-1-ylboronic acid, cis-1-Propene-1-boronic acid
| Molecular Formula | C3H7BO2 |
|---|---|
| Molecular Weight | 86.05 g/mol |
| LogP | -0.4255 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 86.05391 |
| Heavy Atoms | 6 |
| Complexity | 50.0 |
Chemical Identifiers
| CAS Number | 6336-44-3 |
|---|---|
| SMILES | B(C=CC)(O)O |
| InChIKey | CBMCZKMIOZYAHS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Prop-1-enylboronic acid (CAS 6336-44-3), with molecular formula C3H7BO2 and molecular weight 86.05 g/mol. IUPAC: prop-1-enylboronic acid.
Chemical Property Profile of Prop-1-enylboronic acid
Property Insights of Prop-1-enylboronic acid
The XLogP value of -0.4255 indicates that Prop-1-enylboronic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, Prop-1-enylboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Prop-1-enylboronic 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 Prop-1-enylboronic acid?
The CAS number of Prop-1-enylboronic acid is 6336-44-3.
What is the molecular formula of Prop-1-enylboronic acid?
The molecular formula of Prop-1-enylboronic acid is C3H7BO2.
What is the molecular weight of Prop-1-enylboronic acid?
The molecular weight of Prop-1-enylboronic acid is 86.05 g/mol.
Where can I buy Prop-1-enylboronic acid?
You can request a quote for Prop-1-enylboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prop-1-enylboronic acid?
Yes, KEHONG BIO provides custom synthesis services for Prop-1-enylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.