In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2008 | 11 | Yes |
Popular Name: 3-Bromo-2-trifluoromethylpyridine 3-Bromo-2-trifluoromethylpyridine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 590371-58-7 , [590371-58-7]
"3-Bromo-2-(trifluoromethyl)pyridine, 97%"
3-Bromo-2-(trifluoromethyl)pyridine
3-Bromo-2-(trifluoromethyl)pyridine 97%
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) | 2.81 | 4.32 | -6.46 | 0 | 1 | 0 | 13 | 225.995 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.81 | 4.54 | -36.27 | 1 | 1 | 1 | 14 | 227.003 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 34 - 36 | MolMall (formerly Molecular Diversity Preservation International) |
BP | 84-86°/20mmHg | Matrix Scientific |
bp | 97 - 99 (p=35 torr) | MolMall (formerly Molecular Diversity Preservation International) |
Purity | 97% | Fluorochem |
Purity | 99% | Fluorochem |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.