![2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione structure](/static/products/5575/5575-54-2.webp)
2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione
TL;DR: 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione (CAS 5575-54-2) is a chemical compound with molecular formula C9H6O2 and molecular weight 146.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione
Also Known As: 2-methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione, 5-methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione, bicyclo[4.2.0]octa-1,3,5-triene-7,8-dione, 2-methyl-, InChI=1/C9H6O2/c1-5-3-2-4-6-7(5)9(11)8(6)10/h2-4H,1H
| Molecular Formula | C9H6O2 |
|---|---|
| Molecular Weight | 146.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 146.03677 |
| Heavy Atoms | 11 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 5575-54-2 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C(=O)C2=O |
| InChIKey | RJJLSKXWSJWUEZ-UHFFFAOYSA-N |
Product Overview
2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione (CAS 5575-54-2), with molecular formula C9H6O2 and molecular weight 146.04 g/mol. IUPAC: 2-methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione.
Chemical Property Profile of 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione
Property Insights of 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione. With a topological polar surface area (TPSA) of 34.1 Ų, 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione 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 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione?
The CAS number of 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione is 5575-54-2.
What is the molecular formula of 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione?
The molecular formula of 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione is C9H6O2.
What is the molecular weight of 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione?
The molecular weight of 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione is 146.04 g/mol.
Where can I buy 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione?
You can request a quote for 2-Methylbicyclo[4.2.0]octa-1,3,5-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-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylbicyclo[4.2.0]octa-1,3,5-triene-7,8-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.