| CAS Number | 1987057-96-4 |
| Catalog Number | AG00J2AY |
| Chemical Name | 4-isopropyl-2-pyrimidinol hydrochloride |
| IUPAC Name | 6-propan-2-yl-1H-pyrimidin-2-one;hydrochloride |
| InChI | InChI=1S/C7H10N2O.ClH/c1-5(2)6-3-4-8-7(10)9-6;/h3-5H,1-2H3,(H,8,9,10);1H |
| InChI Key | MEWGPNZSMKKXQO-UHFFFAOYSA-N |
| MDL Number | MFCD26959415 |
| Molecular Formula | C7H11ClN2O |
| Molecular Weight | 174.628 |
| SMILES | N1C(C(C)C)=CC=NC=1O.Cl |
| Synonyms | 4-Isopropyl-2-pyrimidinol hydrochloride,
1987057-96-4,
4-isopropylpyrimidin-2-ol HCl,
ZX-CM008891,
MFCD26959415,
1243250-08-9,
|
| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.628g/mol |
| Monoisotopic Mass | 174.056g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number