3-异丁基-2-甲氧基吡嗪
TL;DR: 3-异丁基-2-甲氧基吡嗪 (CAS 24683-00-9) is a chemical compound with molecular formula C9H14N2O and molecular weight 166.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-异丁基-2-甲氧基吡嗪
2-methoxy-3-(2-methylpropyl)pyrazine
Also Known As: 2-ISOBUTYL-3-METHOXYPYRAZINE, 3-Isobutyl-2-methoxypyrazine, 2-Methoxy-3-isobutylpyrazine, 2-Methoxy-3-(2-methylpropyl)pyrazine, 1dzk
| Molecular Formula | C9H14N2O |
|---|---|
| Molecular Weight | 166.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 35.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.11061 |
| Heavy Atoms | 12 |
| Complexity | 128.0 |
| Density | 0.983-1.003 |
| Solubility | soluble in water, organic solvents, oils |
| Refractive Index | 1.487-1.497 |
Chemical Identifiers
| CAS Number | 24683-00-9 |
|---|---|
| SMILES | CC(C)CC1=NC=CN=C1OC |
| InChIKey | UXFSPRAGHGMRSQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-异丁基-2-甲氧基吡嗪 (CAS 24683-00-9), with molecular formula C9H14N2O and molecular weight 166.11 g/mol. IUPAC: 2-methoxy-3-(2-methylpropyl)pyrazine.
Chemical Property Profile of 3-异丁基-2-甲氧基吡嗪
Property Insights of 3-异丁基-2-甲氧基吡嗪
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-异丁基-2-甲氧基吡嗪. With a topological polar surface area (TPSA) of 35.0 Ų, 3-异丁基-2-甲氧基吡嗪 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-异丁基-2-甲氧基吡嗪 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 3-异丁基-2-甲氧基吡嗪?
The CAS number of 3-异丁基-2-甲氧基吡嗪 is 24683-00-9.
What is the molecular formula of 3-异丁基-2-甲氧基吡嗪?
The molecular formula of 3-异丁基-2-甲氧基吡嗪 is C9H14N2O.
What is the molecular weight of 3-异丁基-2-甲氧基吡嗪?
The molecular weight of 3-异丁基-2-甲氧基吡嗪 is 166.11 g/mol.
Where can I buy 3-异丁基-2-甲氧基吡嗪?
You can request a quote for 3-异丁基-2-甲氧基吡嗪 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-异丁基-2-甲氧基吡嗪?
Yes, KEHONG BIO provides custom synthesis services for 3-异丁基-2-甲氧基吡嗪 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.