| CAS Number | 700810-97-5 |
| Catalog Number | AG01BJ15 |
| Chemical Name | 6-chloro-2-methyl-N-phenylpyrimidin-4-amine |
| IUPAC Name | 6-chloro-2-methyl-N-phenylpyrimidin-4-amine |
| InChI | InChI=1S/C11H10ClN3/c1-8-13-10(12)7-11(14-8)15-9-5-3-2-4-6-9/h2-7H,1H3,(H,13,14,15) |
| InChI Key | SKHBMHOHFOFERO-UHFFFAOYSA-N |
| MDL Number | MFCD16768972 |
| Molecular Formula | C11H10ClN3 |
| Molecular Weight | 219.6702 |
| SMILES | CC1=NC(NC2=CC=CC=C2)=CC(Cl)=N1 |
| Synonyms | 6-chloro-2-methyl-N-phenylpyrimidin-4-amine,
700810-97-5,
(6-Chloro-2-methyl-pyrimidin-4-yl)-phenyl-amine,
SCHEMBL1491781,
SKHBMHOHFOFERO-UHFFFAOYSA-N,
ZINC25491566,
AKOS011771521,
4-Pyrimidinamine, 6-chloro-2-methyl-N-phenyl-,
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.672g/mol |
| Monoisotopic Mass | 219.056g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number