![2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione structure](/static/products/624/62416-22-2.png)
2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione
TL;DR: 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione (CAS 62416-22-2) is a chemical compound with molecular formula C9H6O3 and molecular weight 162.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione
Also Known As: 3-Methoxybenzocyclobutene-1,2-dione, 2-methoxybicyclo[4.2.0]octane-7,8-dione, J1.225.831C, 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione, 5-methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione
| Molecular Formula | C9H6O3 |
|---|---|
| Molecular Weight | 162.03 g/mol |
| LogP | 0.4444 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 162.0317 |
| Heavy Atoms | 12 |
| Complexity | 503.58005 |
Chemical Identifiers
| CAS Number | 62416-22-2 |
|---|---|
| SMILES | COC1=CC=CC2=C1C(=O)C2=O |
Product Overview
2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione (CAS 62416-22-2), with molecular formula C9H6O3 and molecular weight 162.03 g/mol. IUPAC: 2-methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione.
Chemical Property Profile of 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione
Property Insights of 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione
The XLogP value of 0.4444 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione. With a topological polar surface area (TPSA) of 43.37 Ų, 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione 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
Frequently Asked Questions
What is the CAS number of 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione?
The CAS number of 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione is 62416-22-2.
What is the molecular formula of 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione?
The molecular formula of 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione is C9H6O3.
What is the molecular weight of 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione?
The molecular weight of 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione is 162.03 g/mol.
Where can I buy 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione?
You can request a quote for 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7,8-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.