| CAS Number | 1139245-06-9 |
| Catalog Number | AG01BS1Z |
| Chemical Name | 4-Chloro-6-(difluoromethyl)-1,3,5-triazin-2-amine |
| IUPAC Name | 4-chloro-6-(difluoromethyl)-1,3,5-triazin-2-amine |
| InChI | InChI=1S/C4H3ClF2N4/c5-3-9-2(1(6)7)10-4(8)11-3/h1H,(H2,8,9,10,11) |
| InChI Key | VHUJEXSWERMPAM-UHFFFAOYSA-N |
| MDL Number | MFCD20721397 |
| Molecular Formula | C4H3ClF2N4 |
| Molecular Weight | 180.5432 |
| SMILES | NC1=NC(C(F)F)=NC(Cl)=N1 |
| Synonyms | 1139245-06-9,
4-chloro-6-(difluoromethyl)-1,3,5-triazin-2-amine,
1,3,5-Triazin-2-amine, 4-chloro-6-(difluoromethyl)-,
AKOS017529451,
ZINC116324294,
|
| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.543g/mol |
| Monoisotopic Mass | 180.001g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 64.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number