Pyrazinecarboxylic acid, pentafluorophenyl ester
TL;DR: Pyrazinecarboxylic acid, pentafluorophenyl ester (CAS 139244-50-1) is a chemical compound with molecular formula C11H3F5N2O2 and molecular weight 290.01147 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,3,4,5,6-pentafluorophenyl) pyrazine-2-carboxylate
Also Known As: Pentafluorophenyl pyrazinoate, Pyrazinecarboxylic acid, pentafluorophenyl ester, Pentafluorophenyl pyrazine-2-carboxylate, 2-Pyrazinecarboxylic acid pentafluorophenyl ester, (2,3,4,5,6-pentafluorophenyl) pyrazine-2-carboxylate
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H3F5N2O2 |
| Molecular Weight | 290.01147 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 52.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.01147 Da |
| Heavy Atoms | 20 |
| Complexity | 346.0 |
| SMILES | C1=CN=C(C=N1)C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F |
| InChIKey | BCDQGCKSLSEGMQ-UHFFFAOYSA-N |
Chemical Property Profile of Pyrazinecarboxylic acid, pentafluorophenyl ester
Property Insights of Pyrazinecarboxylic acid, pentafluorophenyl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazinecarboxylic acid, pentafluorophenyl ester. With a topological polar surface area (TPSA) of 52.1 Ų, Pyrazinecarboxylic acid, pentafluorophenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazinecarboxylic acid, pentafluorophenyl ester has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Pyrazinecarboxylic acid, pentafluorophenyl ester?
The CAS number of Pyrazinecarboxylic acid, pentafluorophenyl ester is 139244-50-1.
What is the molecular formula of Pyrazinecarboxylic acid, pentafluorophenyl ester?
The molecular formula of Pyrazinecarboxylic acid, pentafluorophenyl ester is C11H3F5N2O2.
What is the molecular weight of Pyrazinecarboxylic acid, pentafluorophenyl ester?
The molecular weight of Pyrazinecarboxylic acid, pentafluorophenyl ester is 290.01147 g/mol.
Where can I buy Pyrazinecarboxylic acid, pentafluorophenyl ester?
You can request a quote for Pyrazinecarboxylic acid, pentafluorophenyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pyrazinecarboxylic acid, pentafluorophenyl ester?
Yes, CoreyChem provides custom synthesis services for Pyrazinecarboxylic acid, pentafluorophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.