Methacholine Chloride
TL;DR: Methacholine Chloride (CAS 62-51-1) is a chemical compound with molecular formula C8H18ClNO2 and molecular weight 195.1026 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-acetyloxypropyl(trimethyl)azanium chloride
Also Known As: Methacholine chloride, Provocholine, Amechol, Acetyl-beta-methylcholine chloride, Mecholyl chloride
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H18ClNO2 |
| Molecular Weight | 195.1026 g/mol |
| XLogP | -2.35 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.1026 Da |
| Heavy Atoms | 12 |
| Complexity | 138.0 |
| Solubility | >29.4 [ug/mL] (The mean of the results at pH 7.4) |
| SMILES | CC(C[N+](C)(C)C)OC(=O)C.[Cl-] |
| InChIKey | JHPHVAVFUYTVCL-UHFFFAOYSA-M |
Product Description
Applications: Methacholine Chloride is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, Methacholine Chloride (CAS 62-51-1) has the molecular formula C8H18ClNO2 and a molecular weight of 195.1 g/mol. Reported properties include a solubility: >29.4 [ug/mL] (The mean of the results at pH 7.4). Synonyms include Methacholine chloride and Provocholine.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
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
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 195.1026 g/mol.
What are the applications of Methacholine Chloride?
Methacholine Chloride is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Methacholine Chloride?
You can request a quote for Methacholine Chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methacholine Chloride?
Yes, CoreyChem provides custom synthesis services for Methacholine Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.