Carbamylcholine
TL;DR: Carbamylcholine (CAS 462-58-8) is a chemical compound with molecular formula C6H15N2O2+ and molecular weight 147.11336 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-carbamoyloxyethyl(trimethyl)azanium
Also Known As: carbachol, Carbamylcholine, Carbamoylcholine, Carbastat, Carbacholine
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H15N2O2+ |
| Molecular Weight | 147.11336 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 147.11336 Da |
| Heavy Atoms | 10 |
| Complexity | 117.0 |
| Melting Point | 208-210 |
| Solubility | 1 |
| SMILES | C[N+](C)(C)CCOC(=O)N |
| InChIKey | VPJXQGSRWJZDOB-UHFFFAOYSA-O |
Product Description
Applications: Carbamylcholine 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 Carbamylcholine (CAS 462-58-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Carbamylcholine (CAS 462-58-8) has the molecular formula C6H15N2O2+ and a molecular weight of 147.11 g/mol. Reported properties include a solubility: 1. It is also known as carbachol and Carbamylcholine.
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 Carbamylcholine
Property Insights of Carbamylcholine
The XLogP value of -0.4 indicates that Carbamylcholine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.3 Ų, Carbamylcholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamylcholine 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
What is the CAS number of Carbamylcholine?
The CAS number of Carbamylcholine is 462-58-8.
What is the molecular formula of Carbamylcholine?
The molecular formula of Carbamylcholine is C6H15N2O2+.
What is the molecular weight of Carbamylcholine?
The molecular weight of Carbamylcholine is 147.11336 g/mol.
What are the applications of Carbamylcholine?
Carbamylcholine 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 Carbamylcholine (CAS 462-58-8) with...
Where can I buy Carbamylcholine?
You can request a quote for Carbamylcholine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamylcholine?
Yes, CoreyChem provides custom synthesis services for Carbamylcholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.