ethyl 4-amino-1H-pyrazole-3-carboxylate
TL;DR: ethyl 4-amino-1H-pyrazole-3-carboxylate (CAS 1119477-69-8) is a chemical compound with molecular formula C6H9N3O2 and molecular weight 155.06947 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-amino-1H-pyrazole-5-carboxylate
Also Known As: ethyl 4-amino-1H-pyrazole-5-carboxylate, Ethyl 4-amino-1H-pyrazole-3-carboxylate, 4-AMINO-1H-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER, ethyl 4-aminopyrazole-3-carboxylate, ZERO/005602
Technical Specifications
| Molecular Formula | C6H9N3O2 |
| Molecular Weight | 155.06947 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 81.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 155.06947 Da |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
| SMILES | CCOC(=O)C1=C(C=NN1)N |
| InChIKey | JLIFAQGFWIYWDA-UHFFFAOYSA-N |
Chemical Property Profile of ethyl 4-amino-1H-pyrazole-3-carboxylate
Property Insights of ethyl 4-amino-1H-pyrazole-3-carboxylate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-amino-1H-pyrazole-3-carboxylate. The TPSA of 81.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-amino-1H-pyrazole-3-carboxylate. Following Lipinski's Rule of Five, ethyl 4-amino-1H-pyrazole-3-carboxylate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of ethyl 4-amino-1H-pyrazole-3-carboxylate?
The CAS number of ethyl 4-amino-1H-pyrazole-3-carboxylate is 1119477-69-8.
What is the molecular formula of ethyl 4-amino-1H-pyrazole-3-carboxylate?
The molecular formula of ethyl 4-amino-1H-pyrazole-3-carboxylate is C6H9N3O2.
What is the molecular weight of ethyl 4-amino-1H-pyrazole-3-carboxylate?
The molecular weight of ethyl 4-amino-1H-pyrazole-3-carboxylate is 155.06947 g/mol.
Where can I buy ethyl 4-amino-1H-pyrazole-3-carboxylate?
You can request a quote for ethyl 4-amino-1H-pyrazole-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ethyl 4-amino-1H-pyrazole-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for ethyl 4-amino-1H-pyrazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.