2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol
TL;DR: 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol (CAS 7619-12-7) is a chemical compound with molecular formula C9H20NO2+ and molecular weight 174.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxy-5-methyloxolan-2-yl)methyl-trimethylazanium
Also Known As: Muscarin, Muskarin, MUSCARINE, Muscarine II, (+)-Muscarine
| Molecular Formula | C9H20NO2+ |
|---|---|
| Molecular Weight | 174.15 g/mol |
| LogP | 0.2309 |
| Topological Polar Surface Area | 29.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.1494 |
| Heavy Atoms | 12 |
| Complexity | 143.09775 |
Chemical Identifiers
| CAS Number | 7619-12-7 |
|---|---|
| SMILES | CC1C(CC(O1)C[N+](C)(C)C)O |
Product Overview
2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol (CAS 7619-12-7), with molecular formula C9H20NO2+ and molecular weight 174.15 g/mol. IUPAC: (4-hydroxy-5-methyloxolan-2-yl)methyl-trimethylazanium.
Chemical Property Profile of 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol
Property Insights of 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol
The XLogP value of 0.2309 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol. With a topological polar surface area (TPSA) of 29.46 Ų, 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol 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
Frequently Asked Questions
What is the CAS number of 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol?
The CAS number of 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol is 7619-12-7.
What is the molecular formula of 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol?
The molecular formula of 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol is C9H20NO2+.
What is the molecular weight of 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol?
The molecular weight of 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol is 174.15 g/mol.
Where can I buy 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol?
You can request a quote for 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Anhydro-1,3,6-trideoxy-1-(trimethylazaniumyl)hexitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.