4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde
TL;DR: 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde (CAS 1005700-74-2) is a chemical compound with molecular formula C12H12N2O and molecular weight 200.09496 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-ethylphenyl)-1H-pyrazole-5-carbaldehyde
Also Known As: 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde, 4-(4-ethylphenyl)-1H-pyrazole-5-carbaldehyde, 4-(4-Ethyl-phenyl)-1H-pyrazole-3-carbaldehyde, 4-(4-ethylphenyl)pyrazole-3-carbaldehyde, AB01315700-02
Technical Specifications
| Molecular Formula | C12H12N2O |
| Molecular Weight | 200.09496 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.09496 Da |
| Heavy Atoms | 15 |
| Complexity | 212.0 |
| SMILES | CCC1=CC=C(C=C1)C2=C(NN=C2)C=O |
| InChIKey | OPBKURLXDIBUGQ-UHFFFAOYSA-N |
Chemical Property Profile of 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde
Property Insights of 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde. With a topological polar surface area (TPSA) of 45.8 Ų, 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-ethylphenyl)-1H-pyrazole-3-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
What is the CAS number of 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde?
The CAS number of 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde is 1005700-74-2.
What is the molecular formula of 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde?
The molecular formula of 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde is C12H12N2O.
What is the molecular weight of 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde?
The molecular weight of 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde is 200.09496 g/mol.
Where can I buy 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde?
You can request a quote for 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 4-(4-ethylphenyl)-1H-pyrazole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.