| CAS Number | 57639-21-1 |
| Catalog Number | AG00IA9L(AGN-PC-0WQVOA) |
| Chemical Name | 4-Chloro-6-ethyl-n-methyl-1,3,5-triazin-2-amine |
| IUPAC Name | 4-chloro-6-ethyl-N-methyl-1,3,5-triazin-2-amine |
| InChI | InChI=1S/C6H9ClN4/c1-3-4-9-5(7)11-6(8-2)10-4/h3H2,1-2H3,(H,8,9,10,11) |
| InChI Key | MOVNKVGHCJOYGB-UHFFFAOYSA-N |
| MDL Number | MFCD20665113 |
| Molecular Formula | C6H9ClN4 |
| Molecular Weight | 172.6155 |
| SMILES | CCc1nc(Cl)nc(=NC)[nH]1 |
| Synonyms | 4-chloro-6-ethyl-N-methyl-1,3,5-triazin-2-amine,
57639-21-1,
SCHEMBL7399881,
MFCD20665113,
ZINC39189152,
FCH1246143,
TZ000622,
CS-0035581,
1,3,5-Triazin-2-amine, 4-chloro-6-ethyl-N-methyl-,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.616g/mol |
| Monoisotopic Mass | 172.052g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number