1-(ethoxyethyl)-4-bromo-1H-pyrazole
TL;DR: 1-(ethoxyethyl)-4-bromo-1H-pyrazole (CAS 1024120-52-2) is a chemical compound with molecular formula C7H11BrN2O and molecular weight 218.00548 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-1-(1-ethoxyethyl)pyrazole
Also Known As: 4-bromo-1-(1-ethoxyethyl)-1H-pyrazole, 4-bromo-1-(1-ethoxyethyl)pyrazole, 4-Bromo-1-(1-ethoxy-ethyl)-1H-pyrazole, Baricitinib Impurity 21, Ticagrelor Impurity 171
Technical Specifications
| Molecular Formula | C7H11BrN2O |
| Molecular Weight | 218.00548 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 27.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.00548 Da |
| Heavy Atoms | 11 |
| Complexity | 123.0 |
| SMILES | CCOC(C)N1C=C(C=N1)Br |
| InChIKey | DZXRSNUJYPTUFF-UHFFFAOYSA-N |
Chemical Property Profile of 1-(ethoxyethyl)-4-bromo-1H-pyrazole
Property Insights of 1-(ethoxyethyl)-4-bromo-1H-pyrazole
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(ethoxyethyl)-4-bromo-1H-pyrazole. With a topological polar surface area (TPSA) of 27.1 Ų, 1-(ethoxyethyl)-4-bromo-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(ethoxyethyl)-4-bromo-1H-pyrazole 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 1-(ethoxyethyl)-4-bromo-1H-pyrazole?
The CAS number of 1-(ethoxyethyl)-4-bromo-1H-pyrazole is 1024120-52-2.
What is the molecular formula of 1-(ethoxyethyl)-4-bromo-1H-pyrazole?
The molecular formula of 1-(ethoxyethyl)-4-bromo-1H-pyrazole is C7H11BrN2O.
What is the molecular weight of 1-(ethoxyethyl)-4-bromo-1H-pyrazole?
The molecular weight of 1-(ethoxyethyl)-4-bromo-1H-pyrazole is 218.00548 g/mol.
Where can I buy 1-(ethoxyethyl)-4-bromo-1H-pyrazole?
You can request a quote for 1-(ethoxyethyl)-4-bromo-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(ethoxyethyl)-4-bromo-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 1-(ethoxyethyl)-4-bromo-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.