Picolinoyl Chloride Hydrochloride
TL;DR: Picolinoyl Chloride Hydrochloride (CAS 42115-51-5) is a chemical compound with molecular formula C6H5Cl2NO and molecular weight 176.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyridine-2-carbonyl chloride;hydrochloride
Also Known As: Picolinoyl chloride hydrochloride, Pyridine-2-carbonyl Chloride Hydrochloride, Picolinoyl chloride HCl, 2-Pyridinecarbonyl chloride, hydrochloride, 3-Picolyl chloride hydrochloride
| Molecular Formula | C6H5Cl2NO |
|---|---|
| Molecular Weight | 176.97 g/mol |
| LogP | 1.8824 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.97482 |
| Heavy Atoms | 10 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 42115-51-5 |
|---|---|
| SMILES | C1=CC=NC(=C1)C(=O)Cl.Cl |
| InChIKey | VIPHVHVAGBKHGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Picolinoyl Chloride Hydrochloride (CAS 42115-51-5), with molecular formula C6H5Cl2NO and molecular weight 176.97 g/mol. IUPAC: pyridine-2-carbonyl chloride;hydrochloride.
Chemical Property Profile of Picolinoyl Chloride Hydrochloride
Property Insights of Picolinoyl Chloride Hydrochloride
The XLogP value of 1.8824 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Picolinoyl Chloride Hydrochloride. With a topological polar surface area (TPSA) of 30.0 Ų, Picolinoyl Chloride Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Picolinoyl Chloride Hydrochloride has 1 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 Picolinoyl Chloride Hydrochloride?
The CAS number of Picolinoyl Chloride Hydrochloride is 42115-51-5.
What is the molecular formula of Picolinoyl Chloride Hydrochloride?
The molecular formula of Picolinoyl Chloride Hydrochloride is C6H5Cl2NO.
What is the molecular weight of Picolinoyl Chloride Hydrochloride?
The molecular weight of Picolinoyl Chloride Hydrochloride is 176.97 g/mol.
Where can I buy Picolinoyl Chloride Hydrochloride?
You can request a quote for Picolinoyl Chloride Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Picolinoyl Chloride Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Picolinoyl Chloride Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.