Bicyclo(4.1.1)octa-2,4-diene
TL;DR: Bicyclo(4.1.1)octa-2,4-diene (CAS 61885-53-8) is a chemical compound with molecular formula C8H10 and molecular weight 106.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[4.1.1]octa-2,4-diene
Also Known As: Bicyclo(4.1.1)octa-2,4-diene, Bicyclo[4.1.1]octa-2,4-diene, RefChem:329390
| Molecular Formula | C8H10 |
|---|---|
| Molecular Weight | 106.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 106.07825 |
| Heavy Atoms | 8 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 61885-53-8 |
|---|---|
| SMILES | C1C2CC1C=CC=C2 |
| InChIKey | MHOPACSTYPMMDB-UHFFFAOYSA-N |
Product Overview
Bicyclo(4.1.1)octa-2,4-diene (CAS 61885-53-8), with molecular formula C8H10 and molecular weight 106.08 g/mol. IUPAC: bicyclo[4.1.1]octa-2,4-diene.
Chemical Property Profile of Bicyclo(4.1.1)octa-2,4-diene
Property Insights of Bicyclo(4.1.1)octa-2,4-diene
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo(4.1.1)octa-2,4-diene. With a topological polar surface area (TPSA) of 0.0 Ų, Bicyclo(4.1.1)octa-2,4-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo(4.1.1)octa-2,4-diene 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 Bicyclo(4.1.1)octa-2,4-diene?
The CAS number of Bicyclo(4.1.1)octa-2,4-diene is 61885-53-8.
What is the molecular formula of Bicyclo(4.1.1)octa-2,4-diene?
The molecular formula of Bicyclo(4.1.1)octa-2,4-diene is C8H10.
What is the molecular weight of Bicyclo(4.1.1)octa-2,4-diene?
The molecular weight of Bicyclo(4.1.1)octa-2,4-diene is 106.08 g/mol.
Where can I buy Bicyclo(4.1.1)octa-2,4-diene?
You can request a quote for Bicyclo(4.1.1)octa-2,4-diene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo(4.1.1)octa-2,4-diene?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo(4.1.1)octa-2,4-diene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.