5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde
TL;DR: 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde (CAS 113486-48-9) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09496 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-5-phenyl-3,4-dihydropyrazole-2-carbaldehyde
Also Known As: 5-methyl-3-phenyl-2-pyrazolinecarbaldehyde, 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde, 3-methyl-5-phenyl-3,4-dihydropyrazole-2-carbaldehyde
Technical Specifications
| Molecular Formula | C11H12N2O |
| Molecular Weight | 188.09496 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.09496 Da |
| Heavy Atoms | 14 |
| Complexity | 244.0 |
| SMILES | CC1CC(=NN1C=O)C2=CC=CC=C2 |
| InChIKey | AALJVZPRLNCKCD-UHFFFAOYSA-N |
Chemical Property Profile of 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Property Insights of 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde. With a topological polar surface area (TPSA) of 32.7 Ų, 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-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 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde?
The CAS number of 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde is 113486-48-9.
What is the molecular formula of 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde?
The molecular formula of 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde is C11H12N2O.
What is the molecular weight of 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde?
The molecular weight of 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde is 188.09496 g/mol.
Where can I buy 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde?
You can request a quote for 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 5-methyl-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.