2-氯-5-硝基吡啶
TL;DR: 2-氯-5-硝基吡啶 (CAS 4548-45-2) is a chemical compound with molecular formula C5H3ClN2O2 and molecular weight 157.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氯-5-硝基吡啶
2-chloro-5-nitropyridine
Also Known As: 2-Chloro-5-nitropyridine, Pyridine, 2-chloro-5-nitro-, null, 2-chloro-5-nitro-pyridine, 3-Nitro-6-chloropyridine
| Molecular Formula | C5H3ClN2O2 |
|---|---|
| Molecular Weight | 157.99 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 157.98831 |
| Heavy Atoms | 10 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 4548-45-2 |
|---|---|
| SMILES | C1=CC(=NC=C1[N+](=O)[O-])Cl |
| InChIKey | BAZVFQBTJPBRTJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氯-5-硝基吡啶 (CAS 4548-45-2), with molecular formula C5H3ClN2O2 and molecular weight 157.99 g/mol. IUPAC: 2-chloro-5-nitropyridine.
Chemical Property Profile of 2-氯-5-硝基吡啶
Property Insights of 2-氯-5-硝基吡啶
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氯-5-硝基吡啶. With a topological polar surface area (TPSA) of 58.7 Ų, 2-氯-5-硝基吡啶 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氯-5-硝基吡啶 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-氯-5-硝基吡啶?
The CAS number of 2-氯-5-硝基吡啶 is 4548-45-2.
What is the molecular formula of 2-氯-5-硝基吡啶?
The molecular formula of 2-氯-5-硝基吡啶 is C5H3ClN2O2.
What is the molecular weight of 2-氯-5-硝基吡啶?
The molecular weight of 2-氯-5-硝基吡啶 is 157.99 g/mol.
Where can I buy 2-氯-5-硝基吡啶?
You can request a quote for 2-氯-5-硝基吡啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氯-5-硝基吡啶?
Yes, KEHONG BIO provides custom synthesis services for 2-氯-5-硝基吡啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.