Methacholine
TL;DR: Methacholine (CAS 55-92-5) is a chemical compound with molecular formula C8H18NO2+ and molecular weight 160.13376 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-acetyloxypropyl(trimethyl)azanium
Also Known As: methacholine, Mecholin, Acetylmethylcholine, Methacholin, Mecholine
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H18NO2+ |
| Molecular Weight | 160.13376 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 160.13376 Da |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
| Melting Point | 170-174 |
| SMILES | CC(C[N+](C)(C)C)OC(=O)C |
| InChIKey | NZWOPGCLSHLLPA-UHFFFAOYSA-N |
Product Description
Applications: Methacholine 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. CoreyChem supplies Methacholine (CAS 55-92-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Methacholine is a pharmaceutical intermediate identified by CAS number 55-92-5 and the molecular formula C8H18NO2+ and a molecular weight of 160.13 g/mol. It is also known as methacholine and Mecholin.
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
Property Insights of Methacholine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methacholine. With a topological polar surface area (TPSA) of 26.3 Ų, Methacholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methacholine 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
What is the CAS number of Methacholine?
The CAS number of Methacholine is 55-92-5.
What is the molecular formula of Methacholine?
The molecular formula of Methacholine is C8H18NO2+.
What is the molecular weight of Methacholine?
The molecular weight of Methacholine is 160.13376 g/mol.
What are the applications of Methacholine?
Methacholine 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. CoreyChem supplies Methacholine (CAS 55-92-5) with custom...
Where can I buy Methacholine?
You can request a quote for Methacholine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methacholine?
Yes, CoreyChem provides custom synthesis services for Methacholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.