1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole
TL;DR: 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole (CAS 1006464-91-0) is a chemical compound with molecular formula C9H12N4 and molecular weight 176.1062 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethyl-3-methyl-4-(1H-pyrazol-5-yl)pyrazole
Also Known As: 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole, 1'-Ethyl-3'-methyl-2H,1'H-[3,4']bipyrazolyl, 1'-ethyl-3'-methyl-1H,1'H-3,4'-bipyrazole, 1-ethyl-3-methyl-4-(1H-pyrazol-5-yl)pyrazole, 1-ethyl-3-methyl-4-pyrazol-3-ylpyrazole
Technical Specifications
| Molecular Formula | C9H12N4 |
| Molecular Weight | 176.1062 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.1062 Da |
| Heavy Atoms | 13 |
| Complexity | 173.0 |
| SMILES | CCN1C=C(C(=N1)C)C2=CC=NN2 |
| InChIKey | KKQDQBOHKDZMTM-UHFFFAOYSA-N |
Chemical Property Profile of 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole
Property Insights of 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole. With a topological polar surface area (TPSA) of 46.5 Ų, 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole 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 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole?
The CAS number of 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole is 1006464-91-0.
What is the molecular formula of 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole?
The molecular formula of 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole is C9H12N4.
What is the molecular weight of 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole?
The molecular weight of 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole is 176.1062 g/mol.
Where can I buy 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole?
You can request a quote for 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole?
Yes, CoreyChem provides custom synthesis services for 1'-Ethyl-3'-methyl-1'H,2H-3,4'-bipyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.