Pyridine-4-carbonyl chloride
TL;DR: Pyridine-4-carbonyl chloride (CAS 39178-35-3) is a chemical compound with molecular formula C6H4ClNO and molecular weight 141.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyridine-4-carbonyl chloride
Also Known As: Pyridine-4-carbonyl chloride, Isonicotinoyl chloride, 4-Pyridinecarbonyl chloride, isonicotinic acid chloride, isonicotinoylchloride
| Molecular Formula | C6H4ClNO |
|---|---|
| Molecular Weight | 141.00 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.99814 |
| Heavy Atoms | 9 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 39178-35-3 |
|---|---|
| SMILES | C1=CN=CC=C1C(=O)Cl |
| InChIKey | RVQZKNOMKUSGCI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyridine-4-carbonyl chloride (CAS 39178-35-3), with molecular formula C6H4ClNO and molecular weight 141.00 g/mol. IUPAC: pyridine-4-carbonyl chloride.
Chemical Property Profile of Pyridine-4-carbonyl chloride
Property Insights of Pyridine-4-carbonyl chloride
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine-4-carbonyl chloride. With a topological polar surface area (TPSA) of 30.0 Ų, Pyridine-4-carbonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridine-4-carbonyl chloride 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 Pyridine-4-carbonyl chloride?
The CAS number of Pyridine-4-carbonyl chloride is 39178-35-3.
What is the molecular formula of Pyridine-4-carbonyl chloride?
The molecular formula of Pyridine-4-carbonyl chloride is C6H4ClNO.
What is the molecular weight of Pyridine-4-carbonyl chloride?
The molecular weight of Pyridine-4-carbonyl chloride is 141.00 g/mol.
Where can I buy Pyridine-4-carbonyl chloride?
You can request a quote for Pyridine-4-carbonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine-4-carbonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for Pyridine-4-carbonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.