![3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione structure](/static/products/416/41634-31-5.png)
3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione
TL;DR: 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione (CAS 41634-31-5) is a chemical compound with molecular formula C8H2Cl2O2 and molecular weight 199.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione
Also Known As: 4,5-Dichlorobenzocyclobutene-1,2-dione, 3,4-dichlorobicyclo[4.2.0]octane-7,8-dione, 3,4-dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione
| Molecular Formula | C8H2Cl2O2 |
|---|---|
| Molecular Weight | 199.94 g/mol |
| LogP | 1.7426 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 199.94319 |
| Heavy Atoms | 12 |
| Complexity | 486.13257 |
Chemical Identifiers
| CAS Number | 41634-31-5 |
|---|---|
| SMILES | C1=C2C(=CC(=C1Cl)Cl)C(=O)C2=O |
Product Overview
3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione (CAS 41634-31-5), with molecular formula C8H2Cl2O2 and molecular weight 199.94 g/mol. IUPAC: 3,4-dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione.
Chemical Property Profile of 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione
Property Insights of 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione
The XLogP value of 1.7426 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione. With a topological polar surface area (TPSA) of 34.14 Ų, 3,4-Dichlorobicyclo[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, 3,4-Dichlorobicyclo[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 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione?
The CAS number of 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione is 41634-31-5.
What is the molecular formula of 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione?
The molecular formula of 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione is C8H2Cl2O2.
What is the molecular weight of 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione?
The molecular weight of 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione is 199.94 g/mol.
Where can I buy 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione?
You can request a quote for 3,4-Dichlorobicyclo[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 3,4-Dichlorobicyclo[4.2.0]octa-1,3,5-triene-7,8-dione?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dichlorobicyclo[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.