| CAS Number | 140899-19-0 |
| Catalog Number | AG009Y2R(AGN-PC-0O236F) |
| Chemical Name | 3-(Trifluoromethyl)pyridin-4-ol |
| IUPAC Name | 3-(trifluoromethyl)-1H-pyridin-4-one |
| InChI | InChI=1S/C6H4F3NO/c7-6(8,9)4-3-10-2-1-5(4)11/h1-3H,(H,10,11) |
| InChI Key | MSXWBBIYBYVOPV-UHFFFAOYSA-N |
| MDL Number | MFCD13185668 |
| Molecular Formula | C6H4F3NO |
| Molecular Weight | 163.0973 |
| SMILES | FC(c1c[nH]ccc1=O)(F)F |
| Synonyms | 140899-19-0,
3-(TRIFLUOROMETHYL)PYRIDIN-4-OL,
3-(Trifluoromethyl)pyridin-4(1H)-one,
4-HYDROXY-3-(TRIFLUOROMETHYL)PYRIDINE,
SCHEMBL8766220,
MSXWBBIYBYVOPV-UHFFFAOYSA-N,
4-Pyridinol, 3-(trifluoromethyl)-,
ZINC95775654,
FCH1175884,
MB13374,
AX8338339,
CS-0046229,
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| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.024g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.099g/mol |
| Monoisotopic Mass | 163.024g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number