2-(4-Chlorophenoxy)-4-methoxynicotinonitrile
TL;DR: 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile (CAS 338773-52-7) is a chemical compound with molecular formula C13H9ClN2O2 and molecular weight 260.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenoxy)-4-methoxypyridine-3-carbonitrile
Also Known As: 2-(4-chlorophenoxy)-4-methoxynicotinonitrile, 2-(4-chlorophenoxy)-4-methoxypyridine-3-carbonitrile
| Molecular Formula | C13H9ClN2O2 |
|---|---|
| Molecular Weight | 260.04 g/mol |
| LogP | 3.40758 |
| Topological Polar Surface Area | 55.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.03525 |
| Heavy Atoms | 18 |
| Complexity | 590.9305 |
Chemical Identifiers
| CAS Number | 338773-52-7 |
|---|---|
| SMILES | COC1=C(C(=NC=C1)OC2=CC=C(C=C2)Cl)C#N |
Product Overview
2-(4-Chlorophenoxy)-4-methoxynicotinonitrile (CAS 338773-52-7), with molecular formula C13H9ClN2O2 and molecular weight 260.04 g/mol. IUPAC: 2-(4-chlorophenoxy)-4-methoxypyridine-3-carbonitrile.
Chemical Property Profile of 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile
Property Insights of 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile
The XLogP value of 3.40758 indicates that 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.14 Ų, 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile has 0 hydrogen bond donor(s) and 4 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 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile?
The CAS number of 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile is 338773-52-7.
What is the molecular formula of 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile?
The molecular formula of 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile is C13H9ClN2O2.
What is the molecular weight of 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile?
The molecular weight of 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile is 260.04 g/mol.
Where can I buy 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile?
You can request a quote for 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorophenoxy)-4-methoxynicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.