8-Isocyanoquinoline
TL;DR: 8-Isocyanoquinoline (CAS 3101-17-5) is a chemical compound with molecular formula C10H6N2 and molecular weight 154.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-isocyanoquinoline
Also Known As: 8-isocyanoquinoline, Quinoline, 8-isocyano-, 8-Quinolinylisocyanide, 8-Quinolinyl isocyanide (8CI)
| Molecular Formula | C10H6N2 |
|---|---|
| Molecular Weight | 154.05 g/mol |
| LogP | 2.78559 |
| Topological Polar Surface Area | 17.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 154.0531 |
| Heavy Atoms | 12 |
| Complexity | 449.3404 |
Chemical Identifiers
| CAS Number | 3101-17-5 |
|---|---|
| SMILES | [C-]#[N+]C1=CC=CC2=C1N=CC=C2 |
Product Overview
8-Isocyanoquinoline (CAS 3101-17-5), with molecular formula C10H6N2 and molecular weight 154.05 g/mol. IUPAC: 8-isocyanoquinoline.
Chemical Property Profile of 8-Isocyanoquinoline
Property Insights of 8-Isocyanoquinoline
The XLogP value of 2.78559 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Isocyanoquinoline. With a topological polar surface area (TPSA) of 17.25 Ų, 8-Isocyanoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Isocyanoquinoline has 0 hydrogen bond donor(s) and 1 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 8-Isocyanoquinoline?
The CAS number of 8-Isocyanoquinoline is 3101-17-5.
What is the molecular formula of 8-Isocyanoquinoline?
The molecular formula of 8-Isocyanoquinoline is C10H6N2.
What is the molecular weight of 8-Isocyanoquinoline?
The molecular weight of 8-Isocyanoquinoline is 154.05 g/mol.
Where can I buy 8-Isocyanoquinoline?
You can request a quote for 8-Isocyanoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Isocyanoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 8-Isocyanoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.