Butyl Pyrazine-2-carboxylate
TL;DR: Butyl Pyrazine-2-carboxylate (CAS 41110-19-4) is a chemical compound with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl pyrazine-2-carboxylate
Also Known As: Butyl Pyrazine-2-carboxylate, n-Butyl pyrazinecarboxylate, Pyrazinecarboxylic acid, butyl ester, 2-Pyrazinecarboxylic acid butyl ester, pyrazine-2-carboxylic acid butyl ester
| Molecular Formula | C9H12N2O2 |
|---|---|
| Molecular Weight | 180.09 g/mol |
| LogP | 1.4335 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.08987 |
| Heavy Atoms | 13 |
| Complexity | 261.57703 |
Chemical Identifiers
| CAS Number | 41110-19-4 |
|---|---|
| SMILES | CCCCOC(=O)C1=NC=CN=C1 |
Product Overview
Butyl Pyrazine-2-carboxylate (CAS 41110-19-4), with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol. IUPAC: butyl pyrazine-2-carboxylate.
Chemical Property Profile of Butyl Pyrazine-2-carboxylate
Property Insights of Butyl Pyrazine-2-carboxylate
The XLogP value of 1.4335 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl Pyrazine-2-carboxylate. With a topological polar surface area (TPSA) of 52.08 Ų, Butyl Pyrazine-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl Pyrazine-2-carboxylate has 0 hydrogen bond donor(s) and 4 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 Butyl Pyrazine-2-carboxylate?
The CAS number of Butyl Pyrazine-2-carboxylate is 41110-19-4.
What is the molecular formula of Butyl Pyrazine-2-carboxylate?
The molecular formula of Butyl Pyrazine-2-carboxylate is C9H12N2O2.
What is the molecular weight of Butyl Pyrazine-2-carboxylate?
The molecular weight of Butyl Pyrazine-2-carboxylate is 180.09 g/mol.
Where can I buy Butyl Pyrazine-2-carboxylate?
You can request a quote for Butyl Pyrazine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl Pyrazine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Butyl Pyrazine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.