Sodium 3-bromopyridine-2-carboxylate
TL;DR: Sodium 3-bromopyridine-2-carboxylate (CAS 1189933-55-8) is a chemical compound with molecular formula C6H3BrNNaO2 and molecular weight 222.92448 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
sodium 3-bromopyridine-2-carboxylate
Also Known As: Sodium 3-bromopyridine-2-carboxylate, Sodium 3-bromopicolinate, 3-Bromopicolinic Acid Sodium Salt, Sodium3-bromopicolinate, sodium;3-bromopyridine-2-carboxylate
Technical Specifications
| Molecular Formula | C6H3BrNNaO2 |
| Molecular Weight | 222.92448 g/mol |
| XLogP | -2.7884 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.92448 Da |
| Heavy Atoms | 11 |
| Complexity | 145.0 |
| SMILES | C1=CC(=C(N=C1)C(=O)[O-])Br.[Na+] |
| InChIKey | ITHXTFWQHRHDNV-UHFFFAOYSA-M |
Chemical Property Profile of Sodium 3-bromopyridine-2-carboxylate
Property Insights of Sodium 3-bromopyridine-2-carboxylate
The XLogP value of -2.7884 indicates that Sodium 3-bromopyridine-2-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.0 Ų, Sodium 3-bromopyridine-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sodium 3-bromopyridine-2-carboxylate 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 Sodium 3-bromopyridine-2-carboxylate?
The CAS number of Sodium 3-bromopyridine-2-carboxylate is 1189933-55-8.
What is the molecular formula of Sodium 3-bromopyridine-2-carboxylate?
The molecular formula of Sodium 3-bromopyridine-2-carboxylate is C6H3BrNNaO2.
What is the molecular weight of Sodium 3-bromopyridine-2-carboxylate?
The molecular weight of Sodium 3-bromopyridine-2-carboxylate is 222.92448 g/mol.
Where can I buy Sodium 3-bromopyridine-2-carboxylate?
You can request a quote for Sodium 3-bromopyridine-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sodium 3-bromopyridine-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for Sodium 3-bromopyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.