2,5,6-Trichloro-4-methylnicotinic acid
TL;DR: 2,5,6-Trichloro-4-methylnicotinic acid (CAS 294876-53-2) is a chemical compound with molecular formula C7H4Cl3NO2 and molecular weight 238.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5,6-trichloro-4-methylpyridine-3-carboxylic acid
Also Known As: 2,5,6-Trichloro-4-methylnicotinic acid, 2,5,6-trichloro-4-methylpyridine-3-carboxylic acid, 2,5,6-Trichloro-4-methylnicotinicacid, 2,5,6-Trichloro-4-methylnicotinic acid #, 2,5,6-trichloro-4-methyl-pyridine-3-carboxylic acid
| Molecular Formula | C7H4Cl3NO2 |
|---|---|
| Molecular Weight | 238.93 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 238.93076 |
| Heavy Atoms | 13 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 294876-53-2 |
|---|---|
| SMILES | CC1=C(C(=NC(=C1Cl)Cl)Cl)C(=O)O |
| InChIKey | SSKQQYTWGFOTOY-UHFFFAOYSA-N |
Product Overview
2,5,6-Trichloro-4-methylnicotinic acid (CAS 294876-53-2), with molecular formula C7H4Cl3NO2 and molecular weight 238.93 g/mol. IUPAC: 2,5,6-trichloro-4-methylpyridine-3-carboxylic acid.
Chemical Property Profile of 2,5,6-Trichloro-4-methylnicotinic acid
Property Insights of 2,5,6-Trichloro-4-methylnicotinic acid
The XLogP value of 3.3 indicates that 2,5,6-Trichloro-4-methylnicotinic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 2,5,6-Trichloro-4-methylnicotinic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5,6-Trichloro-4-methylnicotinic acid has 1 hydrogen bond donor(s) and 3 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 2,5,6-Trichloro-4-methylnicotinic acid?
The CAS number of 2,5,6-Trichloro-4-methylnicotinic acid is 294876-53-2.
What is the molecular formula of 2,5,6-Trichloro-4-methylnicotinic acid?
The molecular formula of 2,5,6-Trichloro-4-methylnicotinic acid is C7H4Cl3NO2.
What is the molecular weight of 2,5,6-Trichloro-4-methylnicotinic acid?
The molecular weight of 2,5,6-Trichloro-4-methylnicotinic acid is 238.93 g/mol.
Where can I buy 2,5,6-Trichloro-4-methylnicotinic acid?
You can request a quote for 2,5,6-Trichloro-4-methylnicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5,6-Trichloro-4-methylnicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,5,6-Trichloro-4-methylnicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.