5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole
TL;DR: 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole (CAS 21981-22-6) is a chemical compound with molecular formula C7H14N2 and molecular weight 126.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-3,5-dimethyl-1,4-dihydropyrazole
Also Known As: 5-Ethyl-3,5-dimethyl-2-pyrazoline, 5-ethyl-3,5-dimethyl-1,4-dihydropyrazole, 5-Ethyl-3,5-dimethyl-4,5-dihydro-1H-pyrazole, 3,5-Dimethyl-5-ethyl-.DELTA.[2]-pyrazoline, 1H-Pyrazole, 5-ethyl-4,5-dihydro-3,5-dimethyl-
| Molecular Formula | C7H14N2 |
|---|---|
| Molecular Weight | 126.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 126.1157 |
| Heavy Atoms | 9 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 21981-22-6 |
|---|---|
| SMILES | CCC1(CC(=NN1)C)C |
| InChIKey | DKISPJYYXPWNTG-UHFFFAOYSA-N |
Product Overview
5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole (CAS 21981-22-6), with molecular formula C7H14N2 and molecular weight 126.12 g/mol. IUPAC: 5-ethyl-3,5-dimethyl-1,4-dihydropyrazole.
Chemical Property Profile of 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole
Property Insights of 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole. With a topological polar surface area (TPSA) of 24.4 Ų, 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole 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
Frequently Asked Questions
What is the CAS number of 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole?
The CAS number of 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole is 21981-22-6.
What is the molecular formula of 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole?
The molecular formula of 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole is C7H14N2.
What is the molecular weight of 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole?
The molecular weight of 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole is 126.12 g/mol.
Where can I buy 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole?
You can request a quote for 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-3,5-dimethyl-1,4-dihydropyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.