![[(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate structure](/static/products/873/87362-54-7.png)
[(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate
TL;DR: [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate (CAS 87362-54-7) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate
Also Known As: Bicyclo(3.3.1)nonan-1-ol, 5-methyl-, acetate, [ -4-methyl-8-bicyclo[3.3.1]nonyl]acetate, Bicyclo(3.3.1)nonan-1-ol, 5-methyl-, 1-acetate, Bicyclo[3.3.1]nonan-1-ol, 5-methyl-, acetate
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 2.7643 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 224.36162 |
Chemical Identifiers
| CAS Number | 87362-54-7 |
|---|---|
| SMILES | C[C@@H]1CC[C@H]2C[C@@H]1CC[C@@H]2OC(=O)C |
Product Overview
[(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate (CAS 87362-54-7), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate.
Chemical Property Profile of [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate
Property Insights of [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate
The XLogP value of 2.7643 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate. With a topological polar surface area (TPSA) of 26.3 Ų, [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate 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 [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate?
The CAS number of [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate is 87362-54-7.
What is the molecular formula of [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate?
The molecular formula of [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate is C12H20O2.
What is the molecular weight of [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate?
The molecular weight of [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate is 196.15 g/mol.
Where can I buy [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate?
You can request a quote for [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [(1S,2S,5S,6R)-6-methyl-2-bicyclo[3.3.1]nonanyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.