Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate
TL;DR: Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate (CAS 871817-05-9) is a chemical compound with molecular formula C18H13BN2O and molecular weight 284.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[ethenyl(quinolin-8-yloxy)boranyl]benzonitrile
Also Known As: Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate, 3-(ethenyl-quinolin-8-yloxy-boranyl)benzonitrile, 8-Quinolinyl B-(3-cyanophenyl)-B-ethenylborinate
| Molecular Formula | C18H13BN2O |
|---|---|
| Molecular Weight | 284.11 g/mol |
| LogP | 3.10918 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.1121 |
| Heavy Atoms | 22 |
| Complexity | 864.8402 |
Chemical Identifiers
| CAS Number | 871817-05-9 |
|---|---|
| SMILES | B(C=C)(C1=CC(=CC=C1)C#N)OC2=CC=CC3=C2N=CC=C3 |
Product Overview
Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate (CAS 871817-05-9), with molecular formula C18H13BN2O and molecular weight 284.11 g/mol. IUPAC: 3-[ethenyl(quinolin-8-yloxy)boranyl]benzonitrile.
Chemical Property Profile of Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate
Property Insights of Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate
The XLogP value of 3.10918 indicates that Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate has 0 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 Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate?
The CAS number of Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate is 871817-05-9.
What is the molecular formula of Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate?
The molecular formula of Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate is C18H13BN2O.
What is the molecular weight of Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate?
The molecular weight of Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate is 284.11 g/mol.
Where can I buy Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate?
You can request a quote for Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate?
Yes, KEHONG BIO provides custom synthesis services for Quinolin-8-yl (3-cyanophenyl)(ethenyl)borinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.