| CAS Number | 1242267-93-1 |
| Catalog Number | AG00IWN4(AGN-PC-0WAZI0) |
| Chemical Name | 4-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)-1H-pyrazol-3-amine |
| IUPAC Name | 4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1H-pyrazol-5-amine |
| InChI | InChI=1S/C9H6ClF3N4/c10-6-1-4(9(11,12)13)2-15-7(6)5-3-16-17-8(5)14/h1-3H,(H3,14,16,17) |
| InChI Key | FRFXHXOPUYDYOD-UHFFFAOYSA-N |
| MDL Number | MFCD16622823 |
| Molecular Formula | C9H6ClF3N4 |
| Molecular Weight | 262.6189 |
| SMILES | ClC1(=C(N=CC(=C1)C(F)(F)F)C=2(C(=NNC=2)N)) |
| Synonyms | 4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-pyrazol-3-amine,
1242267-93-1,
4-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)-1H-pyrazol-3-amine,
4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1H-pyrazol-3-amine,
CTK6G6971,
KS-00001Q3T,
ZX-RL003151,
MFCD16622823,
ZINC52507926,
AKOS015848604,
FE-0765,
MCULE-3859406897,
RP14797,
chlorotrifluoromethylpyridinylpyrazolamine,
PC200307,
|
| Complexity | 276 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.023g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 262.62g/mol |
| Monoisotopic Mass | 262.023g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 67.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number