cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid
TL;DR: cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid (CAS 154810-33-0) is a chemical compound with molecular formula C14H15FO3 and molecular weight 250.10052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid
Also Known As: cis-2-(4-fluorobenzoyl)-1-cyclohexane-carboxylic acid, (1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid
Technical Specifications
| Molecular Formula | C14H15FO3 |
| Molecular Weight | 250.10052 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.10052 Da |
| Heavy Atoms | 18 |
| Complexity | 321.0 |
| SMILES | C1CC[C@@H]([C@@H](C1)C(=O)C2=CC=C(C=C2)F)C(=O)O |
| InChIKey | RCCIJJKDNJBQIL-NEPJUHHUSA-N |
Chemical Property Profile of cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid
Property Insights of cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid. With a topological polar surface area (TPSA) of 54.4 Ų, cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid?
The CAS number of cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid is 154810-33-0.
What is the molecular formula of cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid?
The molecular formula of cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid is C14H15FO3.
What is the molecular weight of cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid?
The molecular weight of cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid is 250.10052 g/mol.
Where can I buy cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid?
You can request a quote for cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for cis-(1S,2R)-2-(4-fluorobenzoyl)cyclohexane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.