Pyrazine, 2-chloro-3-methyl-
TL;DR: Pyrazine, 2-chloro-3-methyl- (CAS 95-58-9) is a chemical compound with molecular formula C5H5ClN2 and molecular weight 128.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3-methylpyrazine
Also Known As: 2-Chloro-3-methylpyrazine, 2-Methyl-3-chloropyrazine, Pyrazine, 2-chloro-3-methyl-, null, 2-Chloro-3-methyl-pyrazine
| Molecular Formula | C5H5ClN2 |
|---|---|
| Molecular Weight | 128.01 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.01413 |
| Heavy Atoms | 8 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 95-58-9 |
|---|---|
| SMILES | CC1=NC=CN=C1Cl |
| InChIKey | WZHWPZQQPWKEAV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrazine, 2-chloro-3-methyl- (CAS 95-58-9), with molecular formula C5H5ClN2 and molecular weight 128.01 g/mol. IUPAC: 2-chloro-3-methylpyrazine.
Chemical Property Profile of Pyrazine, 2-chloro-3-methyl-
Property Insights of Pyrazine, 2-chloro-3-methyl-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazine, 2-chloro-3-methyl-. With a topological polar surface area (TPSA) of 25.8 Ų, Pyrazine, 2-chloro-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazine, 2-chloro-3-methyl- 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 Pyrazine, 2-chloro-3-methyl-?
The CAS number of Pyrazine, 2-chloro-3-methyl- is 95-58-9.
What is the molecular formula of Pyrazine, 2-chloro-3-methyl-?
The molecular formula of Pyrazine, 2-chloro-3-methyl- is C5H5ClN2.
What is the molecular weight of Pyrazine, 2-chloro-3-methyl-?
The molecular weight of Pyrazine, 2-chloro-3-methyl- is 128.01 g/mol.
Where can I buy Pyrazine, 2-chloro-3-methyl-?
You can request a quote for Pyrazine, 2-chloro-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazine, 2-chloro-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyrazine, 2-chloro-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.