醋甲胆碱
TL;DR: 醋甲胆碱 (CAS 55-92-5) is a chemical compound with molecular formula C8H18NO2+ and molecular weight 160.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
醋甲胆碱
2-acetyloxypropyl(trimethyl)azanium
Also Known As: methacholine, Mecholin, Acetylmethylcholine, Methacholin, Mecholine
| Molecular Formula | C8H18NO2+ |
|---|---|
| Molecular Weight | 160.13 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 160.13376 |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
| Melting Point | 170-174 |
Chemical Identifiers
| CAS Number | 55-92-5 |
|---|---|
| SMILES | CC(C[N+](C)(C)C)OC(=O)C |
| InChIKey | NZWOPGCLSHLLPA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
醋甲胆碱 (CAS 55-92-5), with molecular formula C8H18NO2+ and molecular weight 160.13 g/mol. IUPAC: 2-acetyloxypropyl(trimethyl)azanium.
Chemical Property Profile of 醋甲胆碱
Property Insights of 醋甲胆碱
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 醋甲胆碱. With a topological polar surface area (TPSA) of 26.3 Ų, 醋甲胆碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 醋甲胆碱 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
Frequently Asked Questions
What is the CAS number of 醋甲胆碱?
The CAS number of 醋甲胆碱 is 55-92-5.
What is the molecular formula of 醋甲胆碱?
The molecular formula of 醋甲胆碱 is C8H18NO2+.
What is the molecular weight of 醋甲胆碱?
The molecular weight of 醋甲胆碱 is 160.13 g/mol.
Where can I buy 醋甲胆碱?
You can request a quote for 醋甲胆碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 醋甲胆碱?
Yes, KEHONG BIO provides custom synthesis services for 醋甲胆碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.