![2-[Chloro(difluoro)methyl]pyridine structure](/static/products/4545/454-58-0.webp)
2-[Chloro(difluoro)methyl]pyridine
TL;DR: 2-[Chloro(difluoro)methyl]pyridine (CAS 454-58-0) is a chemical compound with molecular formula C6H4ClF2N and molecular weight 163.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[chloro(difluoro)methyl]pyridine
Also Known As: 2-[chloro(difluoro)methyl]pyridine, 2-Difluorchlormethyl-pyridin, 2-[Chlorodi(fluoro)methyl]pyridine
| Molecular Formula | C6H4ClF2N |
|---|---|
| Molecular Weight | 163.00 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 163.00003 |
| Heavy Atoms | 10 |
| Complexity | 118.0 |
Chemical Identifiers
| CAS Number | 454-58-0 |
|---|---|
| SMILES | C1=CC=NC(=C1)C(F)(F)Cl |
| InChIKey | NSKXLAVUQXZWJQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[Chloro(difluoro)methyl]pyridine (CAS 454-58-0), with molecular formula C6H4ClF2N and molecular weight 163.00 g/mol. IUPAC: 2-[chloro(difluoro)methyl]pyridine.
Chemical Property Profile of 2-[Chloro(difluoro)methyl]pyridine
Property Insights of 2-[Chloro(difluoro)methyl]pyridine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[Chloro(difluoro)methyl]pyridine. With a topological polar surface area (TPSA) of 12.9 Ų, 2-[Chloro(difluoro)methyl]pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[Chloro(difluoro)methyl]pyridine has 0 hydrogen bond donor(s) and 3 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-[Chloro(difluoro)methyl]pyridine?
The CAS number of 2-[Chloro(difluoro)methyl]pyridine is 454-58-0.
What is the molecular formula of 2-[Chloro(difluoro)methyl]pyridine?
The molecular formula of 2-[Chloro(difluoro)methyl]pyridine is C6H4ClF2N.
What is the molecular weight of 2-[Chloro(difluoro)methyl]pyridine?
The molecular weight of 2-[Chloro(difluoro)methyl]pyridine is 163.00 g/mol.
Where can I buy 2-[Chloro(difluoro)methyl]pyridine?
You can request a quote for 2-[Chloro(difluoro)methyl]pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Chloro(difluoro)methyl]pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-[Chloro(difluoro)methyl]pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.