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CAS NO.1979-98-2
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| 2-Methylthio-4,6-pyrimidinedione Basic information |
| Product Name: | 2-Methylthio-4,6-pyrimidinedione |
| Synonyms: | S-MTBA;S-METHYLTHIOBARBITURIC ACID;4(1H)-PYRIMIDINONE, 6-HYDROXY-2-(METHYLTHIO)-;4,6-DIHYDROXY-2-METHYLTHIOPYRIMIDINE;2-METHYLTHIO-4,6-PYRIMIDINEDIOL;2-Methylthio-4,6-pyrimidinedione;2-(Methylmercapto)-4,6-pyrimidinediol;4,6-dihydroxy-2-methylmercaprimidine |
| CAS: | 1979-98-2 |
| MF: | C5H6N2O2S |
| MW: | 158.18 |
| EINECS: | 217-839-5 |
| Product Categories: | Nucleotides and Nucleosides;Pyrimidines;Pyrimidine;Bases & Related Reagents;Nucleotides;Sulfur & Selenium Compounds;Heterocycle-Pyrimidine series |
| Mol File: | 1979-98-2.mol |
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| 2-Methylthio-4,6-pyrimidinedione Chemical Properties |
| mp | >300 °C(lit.) |
| storage temp. | -20°C Freezer |
| CAS DataBase Reference | 1979-98-2(CAS DataBase Reference) |
| Safety Information |
| Safety Statements | 22-24/25 |
| WGK Germany | 2 |
| Molecular Weight | 158.17834 g/mol |
|---|---|
| Molecular Formula | C5H6N2O2S |
| XLogP3 | 0.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 158.014998 g/mol |
| Monoisotopic Mass | 158.014998 g/mol |
| Topological Polar Surface Area | 87 A^2 |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 222 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |