6-Methyl-4-(trifluoromethyl)nicotinic acid
TL;DR: 6-Methyl-4-(trifluoromethyl)nicotinic acid (CAS 773100-54-2) is a chemical compound with molecular formula C8H6F3NO2 and molecular weight 205.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-4-(trifluoromethyl)pyridine-3-carboxylic acid
Also Known As: 6-methyl-4-(trifluoromethyl)nicotinic acid, BB 0261835, 6-methyl-4-(trifluoromethyl)pyridine-3-carboxylic Acid, 2-Methyl-4-(trifluoromethyl)pyridine-5-carboxylic acid, 6-methyl-4-(trifluoromethyl)nicotinic acid, AldrichCPR
| Molecular Formula | C8H6F3NO2 |
|---|---|
| Molecular Weight | 205.04 g/mol |
| LogP | 2.10702 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.03506 |
| Heavy Atoms | 14 |
| Complexity | 373.33942 |
Chemical Identifiers
| CAS Number | 773100-54-2 |
|---|---|
| SMILES | CC1=CC(=C(C=N1)C(=O)O)C(F)(F)F |
Product Overview
6-Methyl-4-(trifluoromethyl)nicotinic acid (CAS 773100-54-2), with molecular formula C8H6F3NO2 and molecular weight 205.04 g/mol. IUPAC: 6-methyl-4-(trifluoromethyl)pyridine-3-carboxylic acid.
Chemical Property Profile of 6-Methyl-4-(trifluoromethyl)nicotinic acid
Property Insights of 6-Methyl-4-(trifluoromethyl)nicotinic acid
The XLogP value of 2.10702 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methyl-4-(trifluoromethyl)nicotinic acid. With a topological polar surface area (TPSA) of 50.19 Ų, 6-Methyl-4-(trifluoromethyl)nicotinic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methyl-4-(trifluoromethyl)nicotinic acid has 1 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 6-Methyl-4-(trifluoromethyl)nicotinic acid?
The CAS number of 6-Methyl-4-(trifluoromethyl)nicotinic acid is 773100-54-2.
What is the molecular formula of 6-Methyl-4-(trifluoromethyl)nicotinic acid?
The molecular formula of 6-Methyl-4-(trifluoromethyl)nicotinic acid is C8H6F3NO2.
What is the molecular weight of 6-Methyl-4-(trifluoromethyl)nicotinic acid?
The molecular weight of 6-Methyl-4-(trifluoromethyl)nicotinic acid is 205.04 g/mol.
Where can I buy 6-Methyl-4-(trifluoromethyl)nicotinic acid?
You can request a quote for 6-Methyl-4-(trifluoromethyl)nicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methyl-4-(trifluoromethyl)nicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-4-(trifluoromethyl)nicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.