| CAS Number | 111928-64-4 |
| Catalog Number | AG0095G3(AGN-PC-0NXSFL) |
| Chemical Name | 6-Chloro-3-nitro-5-(trifluoromethyl)pyridin-2-amine |
| IUPAC Name | 6-chloro-3-nitro-5-(trifluoromethyl)pyridin-2-amine |
| InChI | InChI=1S/C6H3ClF3N3O2/c7-4-2(6(8,9)10)1-3(13(14)15)5(11)12-4/h1H,(H2,11,12) |
| InChI Key | GVUDDAXTJZAQQM-UHFFFAOYSA-N |
| MDL Number | MFCD27987148 |
| Molecular Formula | C6H3ClF3N3O2 |
| Molecular Weight | 241.5551 |
| SMILES | C1=C(C(=NC(=C1[N+](=O)[O-])N)Cl)C(F)(F)F |
| Synonyms | 6-Chloro-3-nitro-5-(trifluoromethyl)pyridin-2-amine,
111928-64-4,
AK502115,
SCHEMBL8976064,
KS-00000M9P,
MFCD27987148,
ZINC96032069,
DS-19005,
AX8264189,
|
| Complexity | 257 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.987g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.554g/mol |
| Monoisotopic Mass | 240.987g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 84.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number