2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol
TL;DR: 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol (CAS 28219-61-6) is a chemical compound with molecular formula C14H24O and molecular weight 208.18271 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-en-1-ol
Also Known As: Sandacanol, Sandanol, 2-ethyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-en-1-ol, 2-Buten-1-ol, 2-ethyl-4-(2,2,3-trimethyl-3-cyclopenten-1-yl)-, 2-ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H24O |
| Molecular Weight | 208.18271 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.18271 Da |
| Heavy Atoms | 15 |
| Complexity | 271.0 |
| SMILES | CCC(=CCC1CC=C(C1(C)C)C)CO |
| InChIKey | KHQDWCKZXLWDNM-UHFFFAOYSA-N |
Chemical Property Profile of 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol
Property Insights of 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol
The XLogP value of 3.6 indicates that 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol?
The CAS number of 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol is 28219-61-6.
What is the molecular formula of 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol?
The molecular formula of 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol is C14H24O.
What is the molecular weight of 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol?
The molecular weight of 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol is 208.18271 g/mol.
Where can I buy 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol?
You can request a quote for 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol?
Yes, CoreyChem provides custom synthesis services for 2-Ethyl-4-(2',2',3-trimethylcyclopent-3'-enyl)but-2-enol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.