2-Acetyl-3,6-dimethylpyrazine
TL;DR: 2-Acetyl-3,6-dimethylpyrazine (CAS 54300-09-3) is a chemical compound with molecular formula C8H10N2O and molecular weight 150.07932 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,6-dimethylpyrazin-2-yl)ethanone
Also Known As: 2-Acetyl-3,6-dimethylpyrazine, 1-(3,6-dimethylpyrazin-2-yl)ethanone, 1-(3,6-Dimethylpyrazinyl)ethan-1-one, Pyrazine, 2-acetyl-3,6-dimethyl, Ethanone, 1-(3,6-dimethylpyrazinyl)-
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H10N2O |
| Molecular Weight | 150.07932 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 42.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 150.07932 Da |
| Heavy Atoms | 11 |
| Complexity | 158.0 |
| Boiling Point | 238.00 to 239.00 °C. @ 760.00 mm Hg |
| SMILES | CC1=CN=C(C(=N1)C(=O)C)C |
| InChIKey | JFUVDGXTDCVGHA-UHFFFAOYSA-N |
Chemical Property Profile of 2-Acetyl-3,6-dimethylpyrazine
Property Insights of 2-Acetyl-3,6-dimethylpyrazine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Acetyl-3,6-dimethylpyrazine. With a topological polar surface area (TPSA) of 42.9 Ų, 2-Acetyl-3,6-dimethylpyrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Acetyl-3,6-dimethylpyrazine 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
What is the CAS number of 2-Acetyl-3,6-dimethylpyrazine?
The CAS number of 2-Acetyl-3,6-dimethylpyrazine is 54300-09-3.
What is the molecular formula of 2-Acetyl-3,6-dimethylpyrazine?
The molecular formula of 2-Acetyl-3,6-dimethylpyrazine is C8H10N2O.
What is the molecular weight of 2-Acetyl-3,6-dimethylpyrazine?
The molecular weight of 2-Acetyl-3,6-dimethylpyrazine is 150.07932 g/mol.
Where can I buy 2-Acetyl-3,6-dimethylpyrazine?
You can request a quote for 2-Acetyl-3,6-dimethylpyrazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Acetyl-3,6-dimethylpyrazine?
Yes, CoreyChem provides custom synthesis services for 2-Acetyl-3,6-dimethylpyrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.