| CAS Number | 1423026-91-8 |
| Catalog Number | AG01A3EX |
| Chemical Name | 2-methyl-5-phenylpyrimidin-4-amine hydrochloride |
| IUPAC Name | 2-methyl-5-phenylpyrimidin-4-amine;hydrochloride |
| InChI | InChI=1S/C11H11N3.ClH/c1-8-13-7-10(11(12)14-8)9-5-3-2-4-6-9;/h2-7H,1H3,(H2,12,13,14);1H |
| InChI Key | RRJNTWFFIAIWOL-UHFFFAOYSA-N |
| MDL Number | MFCD22741256 |
| Molecular Formula | C11H12ClN3 |
| Molecular Weight | 221.6861 |
| SMILES | Cl.CC1=NC(N)=C(C2=CC=CC=C2)C=N1 |
| Synonyms | 2-methyl-5-phenylpyrimidin-4-amine hydrochloride,
1423026-91-8,
MCULE-9880963761,
NE25927,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.688g/mol |
| Monoisotopic Mass | 221.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number