2,5-bis(1,1-Dimethylethyl)-pyrazine
TL;DR: 2,5-bis(1,1-Dimethylethyl)-pyrazine (CAS 18709-51-8) is a chemical compound with molecular formula C12H20N2 and molecular weight 192.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-ditert-butylpyrazine
Also Known As: 2,5-ditert-butylpyrazine, 2,5-bis(1,1-Dimethylethyl)-pyrazine, 2,5-Di-tert-butylpyrazine, Pyrazine, 2,5-di-tert-butyl-, 2,5-di-tert-butyl-pyrazine
| Molecular Formula | C12H20N2 |
|---|---|
| Molecular Weight | 192.16 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.16264 |
| Heavy Atoms | 14 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 18709-51-8 |
|---|---|
| SMILES | CC(C)(C)C1=CN=C(C=N1)C(C)(C)C |
| InChIKey | NMMZWWJVCYMQAI-UHFFFAOYSA-N |
Product Overview
2,5-bis(1,1-Dimethylethyl)-pyrazine (CAS 18709-51-8), with molecular formula C12H20N2 and molecular weight 192.16 g/mol. IUPAC: 2,5-ditert-butylpyrazine.
Chemical Property Profile of 2,5-bis(1,1-Dimethylethyl)-pyrazine
Property Insights of 2,5-bis(1,1-Dimethylethyl)-pyrazine
The XLogP value of 3.2 indicates that 2,5-bis(1,1-Dimethylethyl)-pyrazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.8 Ų, 2,5-bis(1,1-Dimethylethyl)-pyrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-bis(1,1-Dimethylethyl)-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 2,5-bis(1,1-Dimethylethyl)-pyrazine?
The CAS number of 2,5-bis(1,1-Dimethylethyl)-pyrazine is 18709-51-8.
What is the molecular formula of 2,5-bis(1,1-Dimethylethyl)-pyrazine?
The molecular formula of 2,5-bis(1,1-Dimethylethyl)-pyrazine is C12H20N2.
What is the molecular weight of 2,5-bis(1,1-Dimethylethyl)-pyrazine?
The molecular weight of 2,5-bis(1,1-Dimethylethyl)-pyrazine is 192.16 g/mol.
Where can I buy 2,5-bis(1,1-Dimethylethyl)-pyrazine?
You can request a quote for 2,5-bis(1,1-Dimethylethyl)-pyrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-bis(1,1-Dimethylethyl)-pyrazine?
Yes, KEHONG BIO provides custom synthesis services for 2,5-bis(1,1-Dimethylethyl)-pyrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.