1,2,4,5-(2.2.2.2)-Cyclophane
TL;DR: 1,2,4,5-(2.2.2.2)-Cyclophane (CAS 54100-59-3) is a chemical compound with molecular formula C20H20 and molecular weight 260.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentacyclo[9.7.1.12,10.05,16.07,14]icosa-1(19),2(20),5,7(14),10,15-hexaene
Also Known As: 1,2,3,4>cyclophane, 1,2,4,5-[2.2.2.2]Cyclophane, 1,2,4,5-(2.2.2.2)-Cyclophane, [2.2.2.2](1,2,4,5)Cyclophane, 2,9:3,8-Diethanodibenzo[a,e]cyclooctene, 5,6,11,12-tetrahydro-
| Molecular Formula | C20H20 |
|---|---|
| Molecular Weight | 260.16 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 260.1565 |
| Heavy Atoms | 20 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 54100-59-3 |
|---|---|
| SMILES | C1CC2=CC3=C4CCC5=C(CC3)C=C1C(=C5)CCC2=C4 |
| InChIKey | VKBBYQHRVDUAIS-UHFFFAOYSA-N |
Product Overview
1,2,4,5-(2.2.2.2)-Cyclophane (CAS 54100-59-3), with molecular formula C20H20 and molecular weight 260.16 g/mol. IUPAC: pentacyclo[9.7.1.12,10.05,16.07,14]icosa-1(19),2(20),5,7(14),10,15-hexaene.
Chemical Property Profile of 1,2,4,5-(2.2.2.2)-Cyclophane
Property Insights of 1,2,4,5-(2.2.2.2)-Cyclophane
The XLogP value of 5.0 indicates that 1,2,4,5-(2.2.2.2)-Cyclophane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2,4,5-(2.2.2.2)-Cyclophane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4,5-(2.2.2.2)-Cyclophane 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 1,2,4,5-(2.2.2.2)-Cyclophane?
The CAS number of 1,2,4,5-(2.2.2.2)-Cyclophane is 54100-59-3.
What is the molecular formula of 1,2,4,5-(2.2.2.2)-Cyclophane?
The molecular formula of 1,2,4,5-(2.2.2.2)-Cyclophane is C20H20.
What is the molecular weight of 1,2,4,5-(2.2.2.2)-Cyclophane?
The molecular weight of 1,2,4,5-(2.2.2.2)-Cyclophane is 260.16 g/mol.
Where can I buy 1,2,4,5-(2.2.2.2)-Cyclophane?
You can request a quote for 1,2,4,5-(2.2.2.2)-Cyclophane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4,5-(2.2.2.2)-Cyclophane?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4,5-(2.2.2.2)-Cyclophane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.