Methyl 3-methoxyadamantane-1-carboxylate
TL;DR: Methyl 3-methoxyadamantane-1-carboxylate (CAS 103549-37-7) is a chemical compound with molecular formula C13H20O3 and molecular weight 224.14125 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-methoxyadamantane-1-carboxylate
Also Known As: methyl 3-methoxyadamantane-1-carboxylate, 3-Methoxytricyclo(3.3.1.13,7decane-1-carboxylic acid, methyl ester, 3-Methoxytricyclo[3.3.1.13,7decane-1-carboxylic acid, methyl ester
Technical Specifications
| Molecular Formula | C13H20O3 |
| Molecular Weight | 224.14125 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.14125 Da |
| Heavy Atoms | 16 |
| Complexity | 309.0 |
| SMILES | COC(=O)C12CC3CC(C1)CC(C3)(C2)OC |
| InChIKey | CWOBWCDFHUNRGG-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3-methoxyadamantane-1-carboxylate
Property Insights of Methyl 3-methoxyadamantane-1-carboxylate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-methoxyadamantane-1-carboxylate. With a topological polar surface area (TPSA) of 35.5 Ų, Methyl 3-methoxyadamantane-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-methoxyadamantane-1-carboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 3-methoxyadamantane-1-carboxylate?
The CAS number of Methyl 3-methoxyadamantane-1-carboxylate is 103549-37-7.
What is the molecular formula of Methyl 3-methoxyadamantane-1-carboxylate?
The molecular formula of Methyl 3-methoxyadamantane-1-carboxylate is C13H20O3.
What is the molecular weight of Methyl 3-methoxyadamantane-1-carboxylate?
The molecular weight of Methyl 3-methoxyadamantane-1-carboxylate is 224.14125 g/mol.
Where can I buy Methyl 3-methoxyadamantane-1-carboxylate?
You can request a quote for Methyl 3-methoxyadamantane-1-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3-methoxyadamantane-1-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-methoxyadamantane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.