(1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid
TL;DR: (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid (CAS 161504-24-1) is a chemical compound with molecular formula C6H5F3O4 and molecular weight 198.01399 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trans-(1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid
Also Known As: (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid, 1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic Acid, (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylicacid
Technical Specifications
| Molecular Formula | C6H5F3O4 |
| Molecular Weight | 198.01399 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.01399 Da |
| Heavy Atoms | 13 |
| Complexity | 272.0 |
| SMILES | C1[C@H]([C@]1(C(=O)O)C(F)(F)F)C(=O)O |
| InChIKey | PKHUWUZQELPYRZ-JLAZNSOCSA-N |
Chemical Property Profile of (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid
Property Insights of (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid. Following Lipinski's Rule of Five, (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid?
The CAS number of (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid is 161504-24-1.
What is the molecular formula of (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid?
The molecular formula of (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid is C6H5F3O4.
What is the molecular weight of (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid?
The molecular weight of (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid is 198.01399 g/mol.
Where can I buy (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid?
You can request a quote for (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid?
Yes, CoreyChem provides custom synthesis services for (1R,2R)-1-(trifluoromethyl)cyclopropane-1,2-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.