5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate
TL;DR: 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate (CAS 348596-87-2) is a chemical compound with molecular formula C14H18O4 and molecular weight 250.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl) 2-methylprop-2-enoate
Also Known As: J2.107.521C, 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate, 5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl 2-methylprop-2-enoate, 3-Hydroxy-1-(methacryloyloxy)bicyclo[3.3.1]nonane-7-carboxylic acid lactone
| Molecular Formula | C14H18O4 |
|---|---|
| Molecular Weight | 250.12 g/mol |
| LogP | 1.98 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.12051 |
| Heavy Atoms | 18 |
| Complexity | 427.50992 |
Chemical Identifiers
| CAS Number | 348596-87-2 |
|---|---|
| SMILES | CC(=C)C(=O)OC12CC3CC(C1)C(=O)OC(C3)C2 |
Product Overview
5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate (CAS 348596-87-2), with molecular formula C14H18O4 and molecular weight 250.12 g/mol. IUPAC: (5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl) 2-methylprop-2-enoate.
Chemical Property Profile of 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate
Property Insights of 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate
The XLogP value of 1.98 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate. With a topological polar surface area (TPSA) of 52.6 Ų, 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate 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 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate?
The CAS number of 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate is 348596-87-2.
What is the molecular formula of 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate?
The molecular formula of 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate is C14H18O4.
What is the molecular weight of 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate?
The molecular weight of 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate is 250.12 g/mol.
Where can I buy 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate?
You can request a quote for 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate?
Yes, KEHONG BIO provides custom synthesis services for 5-Oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl methacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.