| CAS Number | 386704-16-1 |
| Catalog Number | AG00C8S4(AGN-PC-0O9OP6) |
| Chemical Name | N-Hydroxy-6-(trifluoromethyl)nicotinimidamide |
| IUPAC Name | N'-hydroxy-6-(trifluoromethyl)pyridine-3-carboximidamide |
| InChI | InChI=1S/C7H6F3N3O/c8-7(9,10)5-2-1-4(3-12-5)6(11)13-14/h1-3,14H,(H2,11,13) |
| InChI Key | VGHPKSQSZUDQBX-UHFFFAOYSA-N |
| MDL Number | MFCD06245538 |
| Molecular Formula | C7H6F3N3O |
| Molecular Weight | 205.1372 |
| SMILES | FC(F)(F)C1=NC=C(C=C1)C(=N)NO |
| Synonyms | N'-hydroxy-6-(trifluoromethyl)nicotinimidamide,
386704-16-1,
6-trifluoromethyl-pyridine-3-amidoxime,
N-Hydroxy-6-(trifluoromethyl)nicotinimidamide,
6-(Trifluoromethyl)pyridine-3-amidoxime,
AC1MCRYH,
3-Pyridinecarboximidamide, N-hydroxy-6-(trifluoromethyl)-,
CTK4I0301,
DTXSID20380639,
VGHPKSQSZUDQBX-UHFFFAOYSA-N,
KS-00003QW8,
(Z)-N-hydroxy-6-(trifluoromethyl)nicotinimidamide,
(E)-N'-hydroxy-6-(trifluoromethyl)nicotinimidamide,
N-hydroxy-6-(trifluoromethyl)-3-pyridinecarboximidamide,
6-(trifluoromethyl)nicotinamidoxime,
ZINC04216292,
CID2777759,
N'-hydroxy-6-(trifluoromethyl)pyridine-3-carboximidamide,
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| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.14g/mol |
| Monoisotopic Mass | 205.046g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 71.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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