5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid
TL;DR: 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid (CAS 956394-41-5) is a chemical compound with molecular formula C10H11F3N2O2 and molecular weight 248.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoic acid
Also Known As: 3-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoic acid, 3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoic Acid, 3-(5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)propanoic acid, 3-(5-cyclopropyl-3-trifluoromethylpyrazol-1-yl)propanoic acid, 3-[5-cyclopropyl-3-(trifluoromethyl)pyrazolyl]propanoic acid
| Molecular Formula | C10H11F3N2O2 |
|---|---|
| Molecular Weight | 248.08 g/mol |
| LogP | 2.254 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.07726 |
| Heavy Atoms | 17 |
| Complexity | 435.24966 |
Chemical Identifiers
| CAS Number | 956394-41-5 |
|---|---|
| SMILES | C1CC1C2=CC(=NN2CCC(=O)O)C(F)(F)F |
Product Overview
5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid (CAS 956394-41-5), with molecular formula C10H11F3N2O2 and molecular weight 248.08 g/mol. IUPAC: 3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoic acid.
Chemical Property Profile of 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid
Property Insights of 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid
The XLogP value of 2.254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid. With a topological polar surface area (TPSA) of 55.12 Ų, 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic 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
Frequently Asked Questions
What is the CAS number of 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid?
The CAS number of 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid is 956394-41-5.
What is the molecular formula of 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid?
The molecular formula of 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid is C10H11F3N2O2.
What is the molecular weight of 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid?
The molecular weight of 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid is 248.08 g/mol.
Where can I buy 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid?
You can request a quote for 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Cyclopropyl-3-(trifluoromethyl)-1H-pyrazole-1-propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.