2,3-Dichloro-6-fluorobenzonitrile
TL;DR: 2,3-Dichloro-6-fluorobenzonitrile (CAS 79544-26-6) is a chemical compound with molecular formula C7H2Cl2FN and molecular weight 188.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dichloro-6-fluorobenzonitrile
Also Known As: 2,3-Dichloro-6-fluorobenzonitrile, 2,3-dichloro-6-fluoro-benzonitrile, 2,3-dichloro-6-fluorobenzenecarbonitrile, RefChem:244566
| Molecular Formula | C7H2Cl2FN |
|---|---|
| Molecular Weight | 188.95 g/mol |
| LogP | 3.00418 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.95483 |
| Heavy Atoms | 11 |
| Complexity | 329.94785 |
Chemical Identifiers
| CAS Number | 79544-26-6 |
|---|---|
| SMILES | C1=CC(=C(C(=C1F)C#N)Cl)Cl |
Product Overview
2,3-Dichloro-6-fluorobenzonitrile (CAS 79544-26-6), with molecular formula C7H2Cl2FN and molecular weight 188.95 g/mol. IUPAC: 2,3-dichloro-6-fluorobenzonitrile.
Chemical Property Profile of 2,3-Dichloro-6-fluorobenzonitrile
Property Insights of 2,3-Dichloro-6-fluorobenzonitrile
The XLogP value of 3.00418 indicates that 2,3-Dichloro-6-fluorobenzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.79 Ų, 2,3-Dichloro-6-fluorobenzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dichloro-6-fluorobenzonitrile 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 2,3-Dichloro-6-fluorobenzonitrile?
The CAS number of 2,3-Dichloro-6-fluorobenzonitrile is 79544-26-6.
What is the molecular formula of 2,3-Dichloro-6-fluorobenzonitrile?
The molecular formula of 2,3-Dichloro-6-fluorobenzonitrile is C7H2Cl2FN.
What is the molecular weight of 2,3-Dichloro-6-fluorobenzonitrile?
The molecular weight of 2,3-Dichloro-6-fluorobenzonitrile is 188.95 g/mol.
Where can I buy 2,3-Dichloro-6-fluorobenzonitrile?
You can request a quote for 2,3-Dichloro-6-fluorobenzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dichloro-6-fluorobenzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dichloro-6-fluorobenzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.