3,5-Dimethyl-2-(3-methylbutyl)pyrazine
TL;DR: 3,5-Dimethyl-2-(3-methylbutyl)pyrazine (CAS 118914-55-9) is a chemical compound with molecular formula C11H18N2 and molecular weight 178.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-2-(3-methylbutyl)pyrazine
Also Known As: dimethylisopentylpyrazine, 2,6-Dimethyl-3-isopentylpyrazine, 3,5-dimethyl-2-(3-methylbutyl)pyrazine, 2-Isopentyl-3,5-dimethylpyrazine, Pyrazine, dimethyl(3-methylbutyl)-
| Molecular Formula | C11H18N2 |
|---|---|
| Molecular Weight | 178.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.147 |
| Heavy Atoms | 13 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 118914-55-9 |
|---|---|
| SMILES | CC1=CN=C(C(=N1)C)CCC(C)C |
| InChIKey | ZVLSVDOZUWIUIJ-UHFFFAOYSA-N |
Product Overview
3,5-Dimethyl-2-(3-methylbutyl)pyrazine (CAS 118914-55-9), with molecular formula C11H18N2 and molecular weight 178.15 g/mol. IUPAC: 3,5-dimethyl-2-(3-methylbutyl)pyrazine.
Chemical Property Profile of 3,5-Dimethyl-2-(3-methylbutyl)pyrazine
Property Insights of 3,5-Dimethyl-2-(3-methylbutyl)pyrazine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethyl-2-(3-methylbutyl)pyrazine. With a topological polar surface area (TPSA) of 25.8 Ų, 3,5-Dimethyl-2-(3-methylbutyl)pyrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethyl-2-(3-methylbutyl)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 3,5-Dimethyl-2-(3-methylbutyl)pyrazine?
The CAS number of 3,5-Dimethyl-2-(3-methylbutyl)pyrazine is 118914-55-9.
What is the molecular formula of 3,5-Dimethyl-2-(3-methylbutyl)pyrazine?
The molecular formula of 3,5-Dimethyl-2-(3-methylbutyl)pyrazine is C11H18N2.
What is the molecular weight of 3,5-Dimethyl-2-(3-methylbutyl)pyrazine?
The molecular weight of 3,5-Dimethyl-2-(3-methylbutyl)pyrazine is 178.15 g/mol.
Where can I buy 3,5-Dimethyl-2-(3-methylbutyl)pyrazine?
You can request a quote for 3,5-Dimethyl-2-(3-methylbutyl)pyrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethyl-2-(3-methylbutyl)pyrazine?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethyl-2-(3-methylbutyl)pyrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.