| CAS Number | 17759-40-9 |
| Catalog Number | AG01FSDF(AGN-PC-3H603D) |
| Chemical Name | (4-Methyl-2-(methylthio)pyrimidin-5-yl)methanol |
| IUPAC Name | (4-methyl-2-methylsulfanylpyrimidin-5-yl)methanol |
| InChI | InChI=1S/C7H10N2OS/c1-5-6(4-10)3-8-7(9-5)11-2/h3,10H,4H2,1-2H3 |
| InChI Key | KZDAADJPBWUPQK-UHFFFAOYSA-N |
| MDL Number | MFCD17677444 |
| Molecular Formula | C7H10N2OS |
| Molecular Weight | 170.2321 |
| SMILES | OCC1=CN=C(SC)N=C1C |
| Synonyms | (4-Methyl-2-(methylthio)pyrimidin-5-yl)methanol,
17759-40-9,
SCHEMBL10816664,
ZINC34451276,
AK671949,
5-(Hydroxymethyl)-4-methyl-2-(methylthio)pyrimidine,
|
| Complexity | 123 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.051384g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.23g/mol |
| Monoisotopic Mass | 170.051384g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 71.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number