| CAS Number | 1955554-19-4 |
| Catalog Number | AG01B2NM |
| Chemical Name | 6-(Aminomethyl)-2-(methylsulfanyl)-1,4-dihydropyrimidin-4-one hydrochloride |
| IUPAC Name | 4-(aminomethyl)-2-methylsulfanyl-1H-pyrimidin-6-one;hydrochloride |
| InChI | InChI=1S/C6H9N3OS.ClH/c1-11-6-8-4(3-7)2-5(10)9-6;/h2H,3,7H2,1H3,(H,8,9,10);1H |
| InChI Key | ODOBJOFWNLOSSK-UHFFFAOYSA-N |
| MDL Number | MFCD29991686 |
| Molecular Formula | C6H10ClN3OS |
| Molecular Weight | 207.6811 |
| SMILES | Cl.CSC1NC(CN)=CC(=O)N=1 |
| Synonyms | 6-(aminomethyl)-2-(methylsulfanyl)-1,4-dihydropyrimidin-4-one hydrochloride,
1955554-19-4,
Z2507870786,
|
| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.023g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.676g/mol |
| Monoisotopic Mass | 207.023g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 92.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number