1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-
TL;DR: 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)- (CAS 66149-44-8) is a chemical compound with molecular formula C12H18 and molecular weight 162.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propan-2-ylidenetricyclo[4.2.1.03,9]nonane
Also Known As: 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-, 1H-Cyclobuta[cd]pentalene,octahydro-1-(1-methylethylidene)-, 1-(propan-2-ylidene)octahydro-1H-cyclobuta[cd]pentalene, 1H-Cyclobuta[cd]pentalene,octahydro-1-(1-methylethylidene)
| Molecular Formula | C12H18 |
|---|---|
| Molecular Weight | 162.14 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 | 162.14085 |
| Heavy Atoms | 12 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 66149-44-8 |
|---|---|
| SMILES | CC(=C1C2CCC3C2C1CC3)C |
| InChIKey | VOHHJWBRHSIESM-UHFFFAOYSA-N |
Product Overview
1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)- (CAS 66149-44-8), with molecular formula C12H18 and molecular weight 162.14 g/mol. IUPAC: 2-propan-2-ylidenetricyclo[4.2.1.03,9]nonane.
Chemical Property Profile of 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-
Property Insights of 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-
The XLogP value of 3.7 indicates that 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)- 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 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-?
The CAS number of 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)- is 66149-44-8.
What is the molecular formula of 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-?
The molecular formula of 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)- is C12H18.
What is the molecular weight of 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-?
The molecular weight of 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)- is 162.14 g/mol.
Where can I buy 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-?
You can request a quote for 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.