Nicotinic acid, 4-(ethylthio)-, hydrobromide
TL;DR: Nicotinic acid, 4-(ethylthio)-, hydrobromide (CAS 74039-06-8) is a chemical compound with molecular formula C8H10BrNO2S and molecular weight 262.96155 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-ethylsulfanylpyridin-1-ium-3-carboxylic acid bromide
Also Known As: 4-(Ethylthio)nicotinic acid hydrobromide, NICOTINIC ACID, 4-(ETHYLTHIO)-, HYDROBROMIDE, 3-carboxy-4-(ethylsulfanyl)pyridinium bromide, 4-Ethylthio-3-pyridinecarboxylic acid hydrobromide, 3-Pyridinecarboxylic acid, 4-ethylthio-, hydrobromide
Technical Specifications
| Molecular Formula | C8H10BrNO2S |
| Molecular Weight | 262.96155 g/mol |
| XLogP | -1.69 |
| Topological Polar Surface Area (TPSA) | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.96155 Da |
| Heavy Atoms | 13 |
| Complexity | 163.0 |
| SMILES | CCSC1=C(C=[NH+]C=C1)C(=O)O.[Br-] |
| InChIKey | FNKCOKZUNFEDSM-UHFFFAOYSA-N |
Chemical Property Profile of Nicotinic acid, 4-(ethylthio)-, hydrobromide
Property Insights of Nicotinic acid, 4-(ethylthio)-, hydrobromide
The XLogP value of -1.69 indicates that Nicotinic acid, 4-(ethylthio)-, hydrobromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Nicotinic acid, 4-(ethylthio)-, hydrobromide. Following Lipinski's Rule of Five, Nicotinic acid, 4-(ethylthio)-, hydrobromide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Nicotinic acid, 4-(ethylthio)-, hydrobromide?
The CAS number of Nicotinic acid, 4-(ethylthio)-, hydrobromide is 74039-06-8.
What is the molecular formula of Nicotinic acid, 4-(ethylthio)-, hydrobromide?
The molecular formula of Nicotinic acid, 4-(ethylthio)-, hydrobromide is C8H10BrNO2S.
What is the molecular weight of Nicotinic acid, 4-(ethylthio)-, hydrobromide?
The molecular weight of Nicotinic acid, 4-(ethylthio)-, hydrobromide is 262.96155 g/mol.
Where can I buy Nicotinic acid, 4-(ethylthio)-, hydrobromide?
You can request a quote for Nicotinic acid, 4-(ethylthio)-, hydrobromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Nicotinic acid, 4-(ethylthio)-, hydrobromide?
Yes, CoreyChem provides custom synthesis services for Nicotinic acid, 4-(ethylthio)-, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.