2,2-Metaparacyclophane
TL;DR: 2,2-Metaparacyclophane (CAS 5385-36-4) is a chemical compound with molecular formula C16H16 and molecular weight 208.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tricyclo[9.2.2.14,8]hexadeca-1(14),4(16),5,7,11(15),12-hexaene
Also Known As: 2,2-Metaparacyclophane, [2.2]metaparacyclophane, [2.2]-metaparacyclophane, 1,3-(p-Phenylenebisethylene)benzene, 1(1,3),4(1,4)-Dibenzenacyclohexaphane
| Molecular Formula | C16H16 |
|---|---|
| Molecular Weight | 208.13 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.1252 |
| Heavy Atoms | 16 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 5385-36-4 |
|---|---|
| SMILES | C1CC2=CC(=CC=C2)CCC3=CC=C1C=C3 |
| InChIKey | ALDQBAILWKRGEG-UHFFFAOYSA-N |
Product Overview
2,2-Metaparacyclophane (CAS 5385-36-4), with molecular formula C16H16 and molecular weight 208.13 g/mol. IUPAC: tricyclo[9.2.2.14,8]hexadeca-1(14),4(16),5,7,11(15),12-hexaene.
Chemical Property Profile of 2,2-Metaparacyclophane
Property Insights of 2,2-Metaparacyclophane
The XLogP value of 3.7 indicates that 2,2-Metaparacyclophane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,2-Metaparacyclophane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Metaparacyclophane 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 2,2-Metaparacyclophane?
The CAS number of 2,2-Metaparacyclophane is 5385-36-4.
What is the molecular formula of 2,2-Metaparacyclophane?
The molecular formula of 2,2-Metaparacyclophane is C16H16.
What is the molecular weight of 2,2-Metaparacyclophane?
The molecular weight of 2,2-Metaparacyclophane is 208.13 g/mol.
Where can I buy 2,2-Metaparacyclophane?
You can request a quote for 2,2-Metaparacyclophane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Metaparacyclophane?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Metaparacyclophane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.