3-氯吡啶
TL;DR: 3-氯吡啶 (CAS 626-60-8) is a chemical compound with molecular formula C5H4ClN and molecular weight 113.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-氯吡啶
3-chloropyridine
Also Known As: 3-CHLOROPYRIDINE, m-Chloropyridine, Pyridine, 3-chloro-, 3-chloro pyridine, mChloropyridine
| Molecular Formula | C5H4ClN |
|---|---|
| Molecular Weight | 113.00 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 113.00323 |
| Heavy Atoms | 7 |
| Complexity | 56.0 |
| Boiling Point | 151 °C |
| Solubility | Slightly soluble in water |
| Flash Point | 66 °C (66.1 °C) - closed cup |
| Vapor Pressure | 4.0 [mmHg] |
| Refractive Index | 1.5304 at 20 °C |
Chemical Identifiers
| CAS Number | 626-60-8 |
|---|---|
| SMILES | C1=CC(=CN=C1)Cl |
| InChIKey | PWRBCZZQRRPXAB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-氯吡啶 (CAS 626-60-8), with molecular formula C5H4ClN and molecular weight 113.00 g/mol. IUPAC: 3-chloropyridine.
Chemical Property Profile of 3-氯吡啶
Property Insights of 3-氯吡啶
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-氯吡啶. With a topological polar surface area (TPSA) of 12.9 Ų, 3-氯吡啶 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-氯吡啶 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 3-氯吡啶?
The CAS number of 3-氯吡啶 is 626-60-8.
What is the molecular formula of 3-氯吡啶?
The molecular formula of 3-氯吡啶 is C5H4ClN.
What is the molecular weight of 3-氯吡啶?
The molecular weight of 3-氯吡啶 is 113.00 g/mol.
Where can I buy 3-氯吡啶?
You can request a quote for 3-氯吡啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-氯吡啶?
Yes, KEHONG BIO provides custom synthesis services for 3-氯吡啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.