1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde
TL;DR: 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde (CAS 154927-02-3) 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.
1-benzyl-5-methylpyrazole-4-carbaldehyde
Also Known As: 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde, 1-benzyl-5-methylpyrazole-4-carbaldehyde, BAS 04914983, 5-methyl-1-benzylpyrazole-4-carbaldehyde, 1-benzyl-5-methyl-pyrazole-4-carbaldehyde
Technical Specifications
| Molecular Formula | C12H12N2O |
| Molecular Weight | 200.09496 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.09496 Da |
| Heavy Atoms | 15 |
| Complexity | 214.0 |
| SMILES | CC1=C(C=NN1CC2=CC=CC=C2)C=O |
| InChIKey | RXFUVCOXOVBENJ-UHFFFAOYSA-N |
Chemical Property Profile of 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde
Property Insights of 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde. With a topological polar surface area (TPSA) of 34.9 Ų, 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde has 0 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 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde?
The CAS number of 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde is 154927-02-3.
What is the molecular formula of 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde?
The molecular formula of 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde is C12H12N2O.
What is the molecular weight of 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde?
The molecular weight of 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde is 200.09496 g/mol.
Where can I buy 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde?
You can request a quote for 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 1-Benzyl-5-methyl-1H-pyrazole-4-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.