5-(4-Chlorophenyl)-2-furonitrile
TL;DR: 5-(4-Chlorophenyl)-2-furonitrile (CAS 52939-07-8) is a chemical compound with molecular formula C11H6ClNO and molecular weight 203.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)furan-2-carbonitrile
Also Known As: 5-(4-chlorophenyl)furan-2-carbonitrile, 5-(4-Chlorophenyl)-2-furonitrile, 5-(p-chlorophenyl)-2-furonitrile, 5-(4-Chlor-phenyl)-2-cyano-furan, 2-Furancarbonitrile, 5-(4-chlorophenyl)-
| Molecular Formula | C11H6ClNO |
|---|---|
| Molecular Weight | 203.01 g/mol |
| LogP | 3.47168 |
| Topological Polar Surface Area | 36.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.0138 |
| Heavy Atoms | 14 |
| Complexity | 478.7338 |
Chemical Identifiers
| CAS Number | 52939-07-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC=C(O2)C#N)Cl |
Product Overview
5-(4-Chlorophenyl)-2-furonitrile (CAS 52939-07-8), with molecular formula C11H6ClNO and molecular weight 203.01 g/mol. IUPAC: 5-(4-chlorophenyl)furan-2-carbonitrile.
Chemical Property Profile of 5-(4-Chlorophenyl)-2-furonitrile
Property Insights of 5-(4-Chlorophenyl)-2-furonitrile
The XLogP value of 3.47168 indicates that 5-(4-Chlorophenyl)-2-furonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.93 Ų, 5-(4-Chlorophenyl)-2-furonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Chlorophenyl)-2-furonitrile 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 5-(4-Chlorophenyl)-2-furonitrile?
The CAS number of 5-(4-Chlorophenyl)-2-furonitrile is 52939-07-8.
What is the molecular formula of 5-(4-Chlorophenyl)-2-furonitrile?
The molecular formula of 5-(4-Chlorophenyl)-2-furonitrile is C11H6ClNO.
What is the molecular weight of 5-(4-Chlorophenyl)-2-furonitrile?
The molecular weight of 5-(4-Chlorophenyl)-2-furonitrile is 203.01 g/mol.
Where can I buy 5-(4-Chlorophenyl)-2-furonitrile?
You can request a quote for 5-(4-Chlorophenyl)-2-furonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Chlorophenyl)-2-furonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Chlorophenyl)-2-furonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.