1-Methyl-3,5-di-t-butylpyrazole
TL;DR: 1-Methyl-3,5-di-t-butylpyrazole (CAS 141665-18-1) is a chemical compound with molecular formula C12H22N2 and molecular weight 194.1783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-ditert-butyl-1-methylpyrazole
Also Known As: 1-Methyl-3,5-di-t-butylpyrazole, Maybridge3_006969, 3,5-ditert-butyl-1-methylpyrazole, 1-methyl-3,5-di-tert-butylpyrazole, 1-methyl-3,5-ditert-butyl-pyrazole
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H22N2 |
| Molecular Weight | 194.1783 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.1783 Da |
| Heavy Atoms | 14 |
| Complexity | 197.0 |
| SMILES | CC(C)(C)C1=CC(=NN1C)C(C)(C)C |
| InChIKey | HOPUBWIABHRCKQ-UHFFFAOYSA-N |
Chemical Property Profile of 1-Methyl-3,5-di-t-butylpyrazole
Property Insights of 1-Methyl-3,5-di-t-butylpyrazole
The XLogP value of 3.6 indicates that 1-Methyl-3,5-di-t-butylpyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.8 Ų, 1-Methyl-3,5-di-t-butylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3,5-di-t-butylpyrazole has 0 hydrogen bond donor(s) and 1 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-Methyl-3,5-di-t-butylpyrazole?
The CAS number of 1-Methyl-3,5-di-t-butylpyrazole is 141665-18-1.
What is the molecular formula of 1-Methyl-3,5-di-t-butylpyrazole?
The molecular formula of 1-Methyl-3,5-di-t-butylpyrazole is C12H22N2.
What is the molecular weight of 1-Methyl-3,5-di-t-butylpyrazole?
The molecular weight of 1-Methyl-3,5-di-t-butylpyrazole is 194.1783 g/mol.
Where can I buy 1-Methyl-3,5-di-t-butylpyrazole?
You can request a quote for 1-Methyl-3,5-di-t-butylpyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methyl-3,5-di-t-butylpyrazole?
Yes, CoreyChem provides custom synthesis services for 1-Methyl-3,5-di-t-butylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.