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6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate
TL;DR: 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate (CAS 54725-50-7) is a chemical compound with molecular formula C11H19NO3 and molecular weight 213.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-methoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) acetate
Also Known As: 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate, (6-methoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) acetate, 6-methoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl acetate, 8-Azabicyclo[3.2.1]octan-3-ol, 6-methoxy-8-methyl-, acetate (ester), 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate #
| Molecular Formula | C11H19NO3 |
|---|---|
| Molecular Weight | 213.14 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.13649 |
| Heavy Atoms | 15 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 54725-50-7 |
|---|---|
| SMILES | CC(=O)OC1CC2CC(C(C1)N2C)OC |
| InChIKey | PVPIJYUIBNCONW-UHFFFAOYSA-N |
Product Overview
6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate (CAS 54725-50-7), with molecular formula C11H19NO3 and molecular weight 213.14 g/mol. IUPAC: (6-methoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) acetate.
Chemical Property Profile of 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate
Property Insights of 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate. With a topological polar surface area (TPSA) of 38.8 Ų, 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate has 0 hydrogen bond donor(s) and 4 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 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate?
The CAS number of 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate is 54725-50-7.
What is the molecular formula of 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate?
The molecular formula of 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate is C11H19NO3.
What is the molecular weight of 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate?
The molecular weight of 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate is 213.14 g/mol.
Where can I buy 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate?
You can request a quote for 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.