1H-Pyrazole, 3-ethoxy-4,5-dimethyl-
TL;DR: 1H-Pyrazole, 3-ethoxy-4,5-dimethyl- (CAS 116570-81-1) is a chemical compound with molecular formula C7H12N2O and molecular weight 140.09496 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethoxy-4,5-dimethyl-1H-pyrazole
Also Known As: 3-ethoxy-4,5-dimethyl-1H-pyrazole, 1H-Pyrazole, 3-ethoxy-4,5-dimethyl-, 5-Ethoxy-3,4-dimethyl-1H-pyrazole, BAS 00126782
Technical Specifications
| Molecular Formula | C7H12N2O |
| Molecular Weight | 140.09496 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 37.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.09496 Da |
| Heavy Atoms | 10 |
| Complexity | 108.0 |
| SMILES | CCOC1=NNC(=C1C)C |
| InChIKey | QHBRIXCDOGTYNX-UHFFFAOYSA-N |
Chemical Property Profile of 1H-Pyrazole, 3-ethoxy-4,5-dimethyl-
Property Insights of 1H-Pyrazole, 3-ethoxy-4,5-dimethyl-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrazole, 3-ethoxy-4,5-dimethyl-. With a topological polar surface area (TPSA) of 37.9 Ų, 1H-Pyrazole, 3-ethoxy-4,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrazole, 3-ethoxy-4,5-dimethyl- 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 1H-Pyrazole, 3-ethoxy-4,5-dimethyl-?
The CAS number of 1H-Pyrazole, 3-ethoxy-4,5-dimethyl- is 116570-81-1.
What is the molecular formula of 1H-Pyrazole, 3-ethoxy-4,5-dimethyl-?
The molecular formula of 1H-Pyrazole, 3-ethoxy-4,5-dimethyl- is C7H12N2O.
What is the molecular weight of 1H-Pyrazole, 3-ethoxy-4,5-dimethyl-?
The molecular weight of 1H-Pyrazole, 3-ethoxy-4,5-dimethyl- is 140.09496 g/mol.
Where can I buy 1H-Pyrazole, 3-ethoxy-4,5-dimethyl-?
You can request a quote for 1H-Pyrazole, 3-ethoxy-4,5-dimethyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-Pyrazole, 3-ethoxy-4,5-dimethyl-?
Yes, CoreyChem provides custom synthesis services for 1H-Pyrazole, 3-ethoxy-4,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.