2-Isobutyl-3-methyl pyrazine
TL;DR: 2-Isobutyl-3-methyl pyrazine (CAS 13925-06-9) is a chemical compound with molecular formula C9H14N2 and molecular weight 150.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-(2-methylpropyl)pyrazine
Also Known As: 2-ISOBUTYL-3-METHYLPYRAZINE, 2-Methyl-3-(2-methylpropyl)pyrazine, 2-isobutyl-3-methyl pyrazine, 2-Methyl-3-isobutylpyrazine, FEMA No. 3133
| Molecular Formula | C9H14N2 |
|---|---|
| Molecular Weight | 150.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 150.11569 |
| Heavy Atoms | 11 |
| Complexity | 112.0 |
| Boiling Point | 199.00 to 201.00 °C. @ 760.00 mm Hg |
| Density | 0.936-0.942 |
| Solubility | soluble in water, oils, organic solvents |
| Refractive Index | 1.488-1.498 |
Chemical Identifiers
| CAS Number | 13925-06-9 |
|---|---|
| SMILES | CC1=NC=CN=C1CC(C)C |
| InChIKey | ZHMIODDNZRIENW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Isobutyl-3-methyl pyrazine (CAS 13925-06-9), with molecular formula C9H14N2 and molecular weight 150.12 g/mol. IUPAC: 2-methyl-3-(2-methylpropyl)pyrazine.
Chemical Property Profile of 2-Isobutyl-3-methyl pyrazine
Property Insights of 2-Isobutyl-3-methyl pyrazine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Isobutyl-3-methyl pyrazine. With a topological polar surface area (TPSA) of 25.8 Ų, 2-Isobutyl-3-methyl pyrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isobutyl-3-methyl pyrazine 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
Frequently Asked Questions
What is the CAS number of 2-Isobutyl-3-methyl pyrazine?
The CAS number of 2-Isobutyl-3-methyl pyrazine is 13925-06-9.
What is the molecular formula of 2-Isobutyl-3-methyl pyrazine?
The molecular formula of 2-Isobutyl-3-methyl pyrazine is C9H14N2.
What is the molecular weight of 2-Isobutyl-3-methyl pyrazine?
The molecular weight of 2-Isobutyl-3-methyl pyrazine is 150.12 g/mol.
Where can I buy 2-Isobutyl-3-methyl pyrazine?
You can request a quote for 2-Isobutyl-3-methyl pyrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Isobutyl-3-methyl pyrazine?
Yes, KEHONG BIO provides custom synthesis services for 2-Isobutyl-3-methyl pyrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.