Methylhomatropine nitrate
TL;DR: Methylhomatropine nitrate (CAS 60539-03-9) is a chemical compound with molecular formula C17H24N2O6 and molecular weight 352.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate nitrate
Also Known As: Methylhomatropine nitrate, N-Methylhomatropinium nitrate, EINECS 262-283-9, (8,8-dimethyl-8-azoniabicyclo[3.2.1]oct-3-yl) 2-hydroxy-2-phenyl-acetate nitrate, (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate nitrate
| Molecular Formula | C17H24N2O6 |
|---|---|
| Molecular Weight | 352.16 g/mol |
| LogP | 1.7939 |
| Topological Polar Surface Area | 112.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.16342 |
| Heavy Atoms | 25 |
| Complexity | 586.41547 |
Chemical Identifiers
| CAS Number | 60539-03-9 |
|---|---|
| SMILES | C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O)C.[N+](=O)([O-])[O-] |
Product Overview
Methylhomatropine nitrate (CAS 60539-03-9), with molecular formula C17H24N2O6 and molecular weight 352.16 g/mol. IUPAC: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate nitrate.
Chemical Property Profile of Methylhomatropine nitrate
Property Insights of Methylhomatropine nitrate
The XLogP value of 1.7939 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methylhomatropine nitrate. The TPSA of 112.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Methylhomatropine nitrate. Following Lipinski's Rule of Five, Methylhomatropine nitrate has 1 hydrogen bond donor(s) and 6 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 Methylhomatropine nitrate?
The CAS number of Methylhomatropine nitrate is 60539-03-9.
What is the molecular formula of Methylhomatropine nitrate?
The molecular formula of Methylhomatropine nitrate is C17H24N2O6.
What is the molecular weight of Methylhomatropine nitrate?
The molecular weight of Methylhomatropine nitrate is 352.16 g/mol.
Where can I buy Methylhomatropine nitrate?
You can request a quote for Methylhomatropine nitrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylhomatropine nitrate?
Yes, KEHONG BIO provides custom synthesis services for Methylhomatropine nitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.