7-Oxabicyclo(2.2.1)hept-5-en-2-one
TL;DR: 7-Oxabicyclo(2.2.1)hept-5-en-2-one (CAS 88708-22-9) is a chemical compound with molecular formula C6H6O2 and molecular weight 110.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-oxabicyclo[2.2.1]hept-5-en-2-one
Also Known As: 7-oxanorbornenone, 7-Oxabicyclo[2.2.1]hept-5-en-2-one, 7-Oxanorborna-5-ene-2-one, UOJMBOVGSKPEHF-UHFFFAOYSA-, 7-Oxabicyclo(2.2.1)hept-5-en-2-one
| Molecular Formula | C6H6O2 |
|---|---|
| Molecular Weight | 110.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 110.03678 |
| Heavy Atoms | 8 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 88708-22-9 |
|---|---|
| SMILES | C1C2C=CC(C1=O)O2 |
| InChIKey | UOJMBOVGSKPEHF-UHFFFAOYSA-N |
Product Overview
7-Oxabicyclo(2.2.1)hept-5-en-2-one (CAS 88708-22-9), with molecular formula C6H6O2 and molecular weight 110.04 g/mol. IUPAC: 7-oxabicyclo[2.2.1]hept-5-en-2-one.
Chemical Property Profile of 7-Oxabicyclo(2.2.1)hept-5-en-2-one
Property Insights of 7-Oxabicyclo(2.2.1)hept-5-en-2-one
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Oxabicyclo(2.2.1)hept-5-en-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, 7-Oxabicyclo(2.2.1)hept-5-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Oxabicyclo(2.2.1)hept-5-en-2-one 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 7-Oxabicyclo(2.2.1)hept-5-en-2-one?
The CAS number of 7-Oxabicyclo(2.2.1)hept-5-en-2-one is 88708-22-9.
What is the molecular formula of 7-Oxabicyclo(2.2.1)hept-5-en-2-one?
The molecular formula of 7-Oxabicyclo(2.2.1)hept-5-en-2-one is C6H6O2.
What is the molecular weight of 7-Oxabicyclo(2.2.1)hept-5-en-2-one?
The molecular weight of 7-Oxabicyclo(2.2.1)hept-5-en-2-one is 110.04 g/mol.
Where can I buy 7-Oxabicyclo(2.2.1)hept-5-en-2-one?
You can request a quote for 7-Oxabicyclo(2.2.1)hept-5-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Oxabicyclo(2.2.1)hept-5-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Oxabicyclo(2.2.1)hept-5-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.