1-Ethylpyrazole-4-carboxylate
TL;DR: 1-Ethylpyrazole-4-carboxylate (CAS 37622-90-5) is a chemical compound with molecular formula C6H7N2O2- and molecular weight 139.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylpyrazole-4-carboxylate
Also Known As: 1-ethylpyrazole-4-carboxylate, ethyl1h-pyrazole-4-carboxylate
| Molecular Formula | C6H7N2O2- |
|---|---|
| Molecular Weight | 139.05 g/mol |
| LogP | -0.7335 |
| Topological Polar Surface Area | 57.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 139.05075 |
| Heavy Atoms | 10 |
| Complexity | 241.65079 |
Chemical Identifiers
| CAS Number | 37622-90-5 |
|---|---|
| SMILES | CCN1C=C(C=N1)C(=O)[O-] |
Product Overview
1-Ethylpyrazole-4-carboxylate (CAS 37622-90-5), with molecular formula C6H7N2O2- and molecular weight 139.05 g/mol. IUPAC: 1-ethylpyrazole-4-carboxylate.
Chemical Property Profile of 1-Ethylpyrazole-4-carboxylate
Property Insights of 1-Ethylpyrazole-4-carboxylate
The XLogP value of -0.7335 indicates that 1-Ethylpyrazole-4-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.95 Ų, 1-Ethylpyrazole-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethylpyrazole-4-carboxylate has 0 hydrogen bond donor(s) and 3 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 1-Ethylpyrazole-4-carboxylate?
The CAS number of 1-Ethylpyrazole-4-carboxylate is 37622-90-5.
What is the molecular formula of 1-Ethylpyrazole-4-carboxylate?
The molecular formula of 1-Ethylpyrazole-4-carboxylate is C6H7N2O2-.
What is the molecular weight of 1-Ethylpyrazole-4-carboxylate?
The molecular weight of 1-Ethylpyrazole-4-carboxylate is 139.05 g/mol.
Where can I buy 1-Ethylpyrazole-4-carboxylate?
You can request a quote for 1-Ethylpyrazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethylpyrazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethylpyrazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.