![[1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane structure](/static/products/2268/226896-69-1.webp)
[1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane
TL;DR: [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane (CAS 226896-69-1) is a chemical compound with molecular formula C20H16 and molecular weight 256.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-phenylphenyl)cubane
Also Known As: 1-(4-phenylphenyl)cubane, 1-([1,1'-Biphenyl]-4-yl)cubane, 1-{[1,1'-biphenyl]-4-yl}cubane, J2.676.143C, [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane
| Molecular Formula | C20H16 |
|---|---|
| Molecular Weight | 256.13 g/mol |
| LogP | 3.9728 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.1252 |
| Heavy Atoms | 20 |
| Complexity | 703.5911 |
Chemical Identifiers
| CAS Number | 226896-69-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C34C5C6C3C7C6C5C47 |
Product Overview
[1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane (CAS 226896-69-1), with molecular formula C20H16 and molecular weight 256.13 g/mol. IUPAC: 1-(4-phenylphenyl)cubane.
Chemical Property Profile of [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane
Property Insights of [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane
The XLogP value of 3.9728 indicates that [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane has 0 hydrogen bond donor(s) and 0 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 [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane?
The CAS number of [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane is 226896-69-1.
What is the molecular formula of [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane?
The molecular formula of [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane is C20H16.
What is the molecular weight of [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane?
The molecular weight of [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane is 256.13 g/mol.
Where can I buy [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane?
You can request a quote for [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane?
Yes, KEHONG BIO provides custom synthesis services for [1,1'-Biphenyl]-4-ylpentacyclo[4.2.0.02,5.03,8.04,7]octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.