![4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile structure](/static/products/1751/175135-35-0.webp)
4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile
TL;DR: 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile (CAS 175135-35-0) is a chemical compound with molecular formula C15H11ClFNO and molecular weight 275.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]acetonitrile
Also Known As: 4-(2-Chloro-6-fluorobenzyloxy)phenylacetonitrile, Maybridge1_001853, 2-(4-((2-Chloro-6-fluorobenzyl)oxy)phenyl)acetonitrile, 4-(2-Chloro-6-Fluorobenzyl-Oxy)Phenylacetonitrile, 2-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]acetonitrile
| Molecular Formula | C15H11ClFNO |
|---|---|
| Molecular Weight | 275.05 g/mol |
| LogP | 4.12418 |
| Topological Polar Surface Area | 33.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.05133 |
| Heavy Atoms | 19 |
| Complexity | 584.2829 |
Chemical Identifiers
| CAS Number | 175135-35-0 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)COC2=CC=C(C=C2)CC#N)F |
Product Overview
4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile (CAS 175135-35-0), with molecular formula C15H11ClFNO and molecular weight 275.05 g/mol. IUPAC: 2-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]acetonitrile.
Chemical Property Profile of 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile
Property Insights of 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile
The XLogP value of 4.12418 indicates that 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.02 Ų, 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile 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 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile?
The CAS number of 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile is 175135-35-0.
What is the molecular formula of 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile?
The molecular formula of 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile is C15H11ClFNO.
What is the molecular weight of 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile?
The molecular weight of 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile is 275.05 g/mol.
Where can I buy 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile?
You can request a quote for 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2-Chloro-6-fluorophenyl)methoxy]benzeneacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.