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Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate
TL;DR: Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate (CAS 38014-79-8) is a chemical compound with molecular formula C10H14O4 and molecular weight 198.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate
Also Known As: methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate, 7-Oxabicyclo[4.2.1]nonane-9-carboxylicacid, 8-oxo-, methyl ester, 8-oxo-7-oxa-bicyclo[4.2.1]nonane-9-carboxylic acid methyl ester
| Molecular Formula | C10H14O4 |
|---|---|
| Molecular Weight | 198.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.0892 |
| Heavy Atoms | 14 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 38014-79-8 |
|---|---|
| SMILES | COC(=O)C1C2CCCCC1OC2=O |
| InChIKey | QNGYNLNQBVPUBQ-UHFFFAOYSA-N |
Product Overview
Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate (CAS 38014-79-8), with molecular formula C10H14O4 and molecular weight 198.09 g/mol. IUPAC: methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate.
Chemical Property Profile of Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate
Property Insights of Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate 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 Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate?
The CAS number of Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate is 38014-79-8.
What is the molecular formula of Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate?
The molecular formula of Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate is C10H14O4.
What is the molecular weight of Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate?
The molecular weight of Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate is 198.09 g/mol.
Where can I buy Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate?
You can request a quote for Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 8-oxo-7-oxabicyclo[4.2.1]nonane-9-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.