2-Fluoro-6-(4-methylphenoxy)benzonitrile
TL;DR: 2-Fluoro-6-(4-methylphenoxy)benzonitrile (CAS 261762-53-2) is a chemical compound with molecular formula C14H10FNO and molecular weight 227.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-6-(4-methylphenoxy)benzonitrile
Also Known As: 2-fluoro-6-(4-methylphenoxy)benzonitrile, 2-Fluoro-6-(p-tolyloxy)benzonitrile, Maybridge1_005681, DivK1c_001969, CDS1_000929
| Molecular Formula | C14H10FNO |
|---|---|
| Molecular Weight | 227.07 g/mol |
| LogP | 3.7981 |
| Topological Polar Surface Area | 33.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.07465 |
| Heavy Atoms | 17 |
| Complexity | 569.76636 |
Chemical Identifiers
| CAS Number | 261762-53-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC2=C(C(=CC=C2)F)C#N |
Product Overview
2-Fluoro-6-(4-methylphenoxy)benzonitrile (CAS 261762-53-2), with molecular formula C14H10FNO and molecular weight 227.07 g/mol. IUPAC: 2-fluoro-6-(4-methylphenoxy)benzonitrile.
Chemical Property Profile of 2-Fluoro-6-(4-methylphenoxy)benzonitrile
Property Insights of 2-Fluoro-6-(4-methylphenoxy)benzonitrile
The XLogP value of 3.7981 indicates that 2-Fluoro-6-(4-methylphenoxy)benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.02 Ų, 2-Fluoro-6-(4-methylphenoxy)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluoro-6-(4-methylphenoxy)benzonitrile has 0 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 2-Fluoro-6-(4-methylphenoxy)benzonitrile?
The CAS number of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is 261762-53-2.
What is the molecular formula of 2-Fluoro-6-(4-methylphenoxy)benzonitrile?
The molecular formula of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is C14H10FNO.
What is the molecular weight of 2-Fluoro-6-(4-methylphenoxy)benzonitrile?
The molecular weight of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is 227.07 g/mol.
Where can I buy 2-Fluoro-6-(4-methylphenoxy)benzonitrile?
You can request a quote for 2-Fluoro-6-(4-methylphenoxy)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluoro-6-(4-methylphenoxy)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluoro-6-(4-methylphenoxy)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.