2,2-Diethylcyclopropanecarboxylic acid
TL;DR: 2,2-Diethylcyclopropanecarboxylic acid (CAS 108708-27-6) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2-diethylcyclopropane-1-carboxylic acid
Also Known As: 2,2-diethylcyclopropanecarboxylic acid, null, 2,2-diethylcyclopropane-1-carboxylic acid, NCIOpen2_001541, 2,2-diethylcyclopropanecarboxylicacid
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H14O2 |
| Molecular Weight | 142.09938 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 142.09938 Da |
| Heavy Atoms | 10 |
| Complexity | 147.0 |
| SMILES | CCC1(CC1C(=O)O)CC |
| InChIKey | VVIHKNHVJCKLQQ-UHFFFAOYSA-N |
Chemical Property Profile of 2,2-Diethylcyclopropanecarboxylic acid
Property Insights of 2,2-Diethylcyclopropanecarboxylic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Diethylcyclopropanecarboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2,2-Diethylcyclopropanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Diethylcyclopropanecarboxylic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,2-Diethylcyclopropanecarboxylic acid?
The CAS number of 2,2-Diethylcyclopropanecarboxylic acid is 108708-27-6.
What is the molecular formula of 2,2-Diethylcyclopropanecarboxylic acid?
The molecular formula of 2,2-Diethylcyclopropanecarboxylic acid is C8H14O2.
What is the molecular weight of 2,2-Diethylcyclopropanecarboxylic acid?
The molecular weight of 2,2-Diethylcyclopropanecarboxylic acid is 142.09938 g/mol.
Where can I buy 2,2-Diethylcyclopropanecarboxylic acid?
You can request a quote for 2,2-Diethylcyclopropanecarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2-Diethylcyclopropanecarboxylic acid?
Yes, CoreyChem provides custom synthesis services for 2,2-Diethylcyclopropanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.