8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane
TL;DR: 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane (CAS 42607-62-5) is a chemical compound with molecular formula C13H14 and molecular weight 170.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,11-dimethylidenepentacyclo[5.4.0.02,6.03,10.05,9]undecane
Also Known As: N,S-benzylidene-cysteine, 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane, 8,11-Dimethylenepentacyclo[5.4.0.02,6.03,10.05,9]undecane, 8,11-dimethylidenepentacyclo[5.4.0.02,6.03,10.05,9]undecane, 1,2,4-Ethanylylidene-1H-cyclobuta[cd]pentalene,octahydro-5,7-bis(methylene)-
| Molecular Formula | C13H14 |
|---|---|
| Molecular Weight | 170.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.10954 |
| Heavy Atoms | 13 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 42607-62-5 |
|---|---|
| SMILES | C=C1C2C3CC4C2C(=C)C5C4C3C51 |
| InChIKey | MLCGADSRPXNURO-UHFFFAOYSA-N |
Product Overview
8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane (CAS 42607-62-5), with molecular formula C13H14 and molecular weight 170.11 g/mol. IUPAC: 8,11-dimethylidenepentacyclo[5.4.0.02,6.03,10.05,9]undecane.
Chemical Property Profile of 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane
Property Insights of 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane. With a topological polar surface area (TPSA) of 0.0 Ų, 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane 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 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane?
The CAS number of 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane is 42607-62-5.
What is the molecular formula of 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane?
The molecular formula of 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane is C13H14.
What is the molecular weight of 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane?
The molecular weight of 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane is 170.11 g/mol.
Where can I buy 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane?
You can request a quote for 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane?
Yes, KEHONG BIO provides custom synthesis services for 8,11-Dimethylenepentacyclo(5.4.0.02,6.03,10.05,9)undecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.