![3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde structure](/static/products/3069/306936-65-2.webp)
3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde
TL;DR: 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde (CAS 306936-65-2) is a chemical compound with molecular formula C11H7F3N2O and molecular weight 240.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde
Also Known As: 3-[4-(TRIFLUOROMETHYL)PHENYL]-1H-PYRAZOLE-4-CARBALDEHYDE, 3-(4-(trifluoromethyl)phenyl)-1h-pyrazole-4-carbaldehyde, 5-[4-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde, 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carboxaldehyde, 1H-Pyrazole-4-carboxaldehyde, 3-[4-(trifluoromethyl)phenyl]-
| Molecular Formula | C11H7F3N2O |
|---|---|
| Molecular Weight | 240.05 g/mol |
| LogP | 2.908 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.05104 |
| Heavy Atoms | 17 |
| Complexity | 528.3947 |
Chemical Identifiers
| CAS Number | 306936-65-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C(C=NN2)C=O)C(F)(F)F |
Product Overview
3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde (CAS 306936-65-2), with molecular formula C11H7F3N2O and molecular weight 240.05 g/mol. IUPAC: 5-[4-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde.
Chemical Property Profile of 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde
Property Insights of 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde
The XLogP value of 2.908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde. With a topological polar surface area (TPSA) of 45.75 Ų, 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde 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 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde?
The CAS number of 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde is 306936-65-2.
What is the molecular formula of 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde?
The molecular formula of 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde is C11H7F3N2O.
What is the molecular weight of 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde?
The molecular weight of 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde is 240.05 g/mol.
Where can I buy 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde?
You can request a quote for 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.