![2-Oxabicyclo[3.2.1]octa-3,6-diene structure](/static/products/4729/4729-06-0.webp)
2-Oxabicyclo[3.2.1]octa-3,6-diene
TL;DR: 2-Oxabicyclo[3.2.1]octa-3,6-diene (CAS 4729-06-0) is a chemical compound with molecular formula C7H8O and molecular weight 108.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxabicyclo[3.2.1]octa-3,6-diene
Also Known As: 2-Oxabicyclo[3.2.1]octa-3,6-diene, 4-oxabicyclo[3.2.1]octa-2,6-diene, 2-Oxabicyclo octa-3,6-diene, 2-Oxabicyclo(3.2.1)octa-3,6-diene, 2-Oxa-Bicyclo<3.2.1>octa-3,6-dien
| Molecular Formula | C7H8O |
|---|---|
| Molecular Weight | 108.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 108.05752 |
| Heavy Atoms | 8 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 4729-06-0 |
|---|---|
| SMILES | C1C2C=CC1OC=C2 |
| InChIKey | JPFHUVOCZRXQMU-UHFFFAOYSA-N |
Product Overview
2-Oxabicyclo[3.2.1]octa-3,6-diene (CAS 4729-06-0), with molecular formula C7H8O and molecular weight 108.06 g/mol. IUPAC: 2-oxabicyclo[3.2.1]octa-3,6-diene.
Chemical Property Profile of 2-Oxabicyclo[3.2.1]octa-3,6-diene
Property Insights of 2-Oxabicyclo[3.2.1]octa-3,6-diene
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxabicyclo[3.2.1]octa-3,6-diene. With a topological polar surface area (TPSA) of 9.2 Ų, 2-Oxabicyclo[3.2.1]octa-3,6-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxabicyclo[3.2.1]octa-3,6-diene has 0 hydrogen bond donor(s) and 1 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 2-Oxabicyclo[3.2.1]octa-3,6-diene?
The CAS number of 2-Oxabicyclo[3.2.1]octa-3,6-diene is 4729-06-0.
What is the molecular formula of 2-Oxabicyclo[3.2.1]octa-3,6-diene?
The molecular formula of 2-Oxabicyclo[3.2.1]octa-3,6-diene is C7H8O.
What is the molecular weight of 2-Oxabicyclo[3.2.1]octa-3,6-diene?
The molecular weight of 2-Oxabicyclo[3.2.1]octa-3,6-diene is 108.06 g/mol.
Where can I buy 2-Oxabicyclo[3.2.1]octa-3,6-diene?
You can request a quote for 2-Oxabicyclo[3.2.1]octa-3,6-diene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxabicyclo[3.2.1]octa-3,6-diene?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxabicyclo[3.2.1]octa-3,6-diene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.