3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one
TL;DR: 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one (CAS 22246-27-1) is a chemical compound with molecular formula C9H8O2 and molecular weight 148.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxybicyclo[4.2.0]octa-1(6),2,4-trien-7-one
Also Known As: 4-methoxybenzocyclobutenone, 4-Methoxy-benzocyclobutenon, (R)-2-Phenyl-1-tosylaziridine, 4-Methoxy-1,2-dihydrobenzocyclobutene-1-one, 3-METHOXYBICYCLO[4.2.0]OCTA-1,3,5-TRIEN-7-ONE
| Molecular Formula | C9H8O2 |
|---|---|
| Molecular Weight | 148.05 g/mol |
| LogP | 1.434 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 148.05243 |
| Heavy Atoms | 11 |
| Complexity | 315.3388 |
Chemical Identifiers
| CAS Number | 22246-27-1 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(=O)C2 |
Product Overview
3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one (CAS 22246-27-1), with molecular formula C9H8O2 and molecular weight 148.05 g/mol. IUPAC: 3-methoxybicyclo[4.2.0]octa-1(6),2,4-trien-7-one.
Chemical Property Profile of 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one
Property Insights of 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one
The XLogP value of 1.434 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-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 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one?
The CAS number of 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one is 22246-27-1.
What is the molecular formula of 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one?
The molecular formula of 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one is C9H8O2.
What is the molecular weight of 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one?
The molecular weight of 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one is 148.05 g/mol.
Where can I buy 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one?
You can request a quote for 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxybicyclo(4.2.0)octa-1,3,5-trien-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.