Methacholine Chloride
TL;DR: Methacholine Chloride (CAS 62-51-1) is a chemical compound with molecular formula C8H18ClNO2 and molecular weight 195.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyloxypropyl(trimethyl)azanium chloride
Also Known As: Methacholine chloride, Provocholine, Amechol, Acetyl-beta-methylcholine chloride, Mecholyl chloride
| Molecular Formula | C8H18ClNO2 |
|---|---|
| Molecular Weight | 195.10 g/mol |
| LogP | -2.35 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.1026 |
| Heavy Atoms | 12 |
| Complexity | 138.0 |
| Solubility | >29.4 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 62-51-1 |
|---|---|
| SMILES | CC(C[N+](C)(C)C)OC(=O)C.[Cl-] |
| InChIKey | JHPHVAVFUYTVCL-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methacholine Chloride (CAS 62-51-1), with molecular formula C8H18ClNO2 and molecular weight 195.10 g/mol. IUPAC: 2-acetyloxypropyl(trimethyl)azanium chloride.
Chemical Property Profile of Methacholine Chloride
Property Insights of Methacholine Chloride
The XLogP value of -2.35 indicates that Methacholine Chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 26.3 Ų, Methacholine Chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methacholine Chloride 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 Methacholine Chloride?
The CAS number of Methacholine Chloride is 62-51-1.
What is the molecular formula of Methacholine Chloride?
The molecular formula of Methacholine Chloride is C8H18ClNO2.
What is the molecular weight of Methacholine Chloride?
The molecular weight of Methacholine Chloride is 195.10 g/mol.
Where can I buy Methacholine Chloride?
You can request a quote for Methacholine Chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methacholine Chloride?
Yes, KEHONG BIO provides custom synthesis services for Methacholine Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.