| CAS Number | 1248452-50-7 |
| Catalog Number | AG01AF0V(AGN-PC-0WOB4U) |
| Chemical Name | 3-(Trifluoromethyl)-1H-pyrazol-4-amine |
| IUPAC Name | 5-(trifluoromethyl)-1H-pyrazol-4-amine |
| InChI | InChI=1S/C4H4F3N3/c5-4(6,7)3-2(8)1-9-10-3/h1H,8H2,(H,9,10) |
| InChI Key | DUICMNHYJPXUBT-UHFFFAOYSA-N |
| MDL Number | MFCD16065409 |
| Molecular Formula | C4H4F3N3 |
| Molecular Weight | 151.0899 |
| SMILES | FC(C1=NNC=C1N)(F)F |
| Synonyms | 3-(Trifluoromethyl)-1H-pyrazol-4-amine,
1248452-50-7,
ZINC43299016,
AKOS010896745,
CS-0080489,
3-Trifluoromethyl-1H-pyrazol-4-ylamine,
|
| Complexity | 123 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 151.036g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.092g/mol |
| Monoisotopic Mass | 151.036g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 54.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number