![3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene structure](/static/products/5399/53995-96-3.webp)
3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene
TL;DR: 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene (CAS 53995-96-3) is a chemical compound with molecular formula C10H12O2 and molecular weight 164.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-triene
Also Known As: 3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-triene, Bicyclo[4.2.0]octa-1,3,5-triene, 3,4-dimethoxy-, Bicyclo[4.2.0]octa-1,3,5-triene,3,4-dimethoxy
| Molecular Formula | C10H12O2 |
|---|---|
| Molecular Weight | 164.08 g/mol |
| LogP | 1.8024 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 164.08372 |
| Heavy Atoms | 12 |
| Complexity | 273.95206 |
Chemical Identifiers
| CAS Number | 53995-96-3 |
|---|---|
| SMILES | COC1=C(C=C2CCC2=C1)OC |
Product Overview
3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene (CAS 53995-96-3), with molecular formula C10H12O2 and molecular weight 164.08 g/mol. IUPAC: 3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-triene.
Chemical Property Profile of 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene
Property Insights of 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene
The XLogP value of 1.8024 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene. With a topological polar surface area (TPSA) of 18.46 Ų, 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene 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-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene?
The CAS number of 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene is 53995-96-3.
What is the molecular formula of 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene?
The molecular formula of 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene is C10H12O2.
What is the molecular weight of 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene?
The molecular weight of 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene is 164.08 g/mol.
Where can I buy 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene?
You can request a quote for 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-triene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.