| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 13 | Yes |
Popular Name: 6-(trifluoromethyl)nicotinic acid 6-(trifluoromethyl)nicotinic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 231291-22- , 231291-22-8 , [231291-22-8]
"6-Trifluoromethyl nicotinic acid, 98%"
2-Trifluoromethyl-5-pyridinecarboxylic acid
6-(Trifluoromethyl)nicotinic acid 98%
6-(Trifluoromethyl)nicotinic acid, 97%
6-(Trifluoromethyl)NicotinicAcid
6-(Trifluoromethyl)pyridine-3-carboxylic acid
6-(Trifluoromethyl)pyridine-3-carboxylic acid, 5-Carboxy-2-(trifluoromethyl)pyridine
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.24 | 3.36 | -40.52 | 0 | 3 | -1 | 53 | 190.1 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 188 - 189 | MolMall (formerly Molecular Diversity Preservation International) |
| melting_point | 190 - 192 | KeyOrganics |
| Melting_Point | 191-192? | Alfa-Aesar |
| Melting_Point | 191-192° | Alfa-Aesar |
| MP | 191-195° | Oakwood Chemical |
| MP | 193 - 197 | Enamine Building Blocks |
| MP | 193...197 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.