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| CAS No.: | 15231-48-8 |
|---|---|
| Name: | 2-HYDROXY-4-METHYLPYRIMIDINE |
| Article Data: | 15 |
| Molecular Structure: | |
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| Formula: | C5H6N2O |
| Molecular Weight: | 110.115 |
| Synonyms: | 2-Pyrimidinol,4-methyl- (5CI);2-Hydroxy-4-methylpyrimidine;4-Methyl-2(1H)-pyrimidinone;4-Methyl-2-hydroxypyrimidine;4-Methylpyrimidin-2-ol; |
| EINECS: | 226-306-6 |
| Density: | 1.22 g/cm3 |
| Melting Point: | 240-241°C |
| Boiling Point: | 309.1 °C at 760 mmHg |
| Flash Point: | 140.8 °C |
| Appearance: | Green-yellow solid |
| PSA: | 46.01000 |
| LogP: | 0.49060 |
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Specification
The 2(1H)-Pyrimidinone,4-methyl-, with the CAS registry number 15231-48-8, is also known as 4-Methyl-2-oxo-(1H)-pyrimidine. It belongs to the product categories of Pyrimidine; Nucleotides and Nucleosides; Bases & Related Reagents; Nucleotides. This chemical's molecular formula is C5H6N2O and molecular weight is 110.1139. Its systematic name is called 6-methylpyrimidin-2(1H)-one. This chemical is green-yellow solid.
Physical properties of 2(1H)-Pyrimidinone,4-methyl-: (1)ACD/LogP: -1.03; (2)ACD/LogD (pH 5.5): -1.45; (3)ACD/LogD (pH 7.4): -1.45; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 3.86; (7)ACD/KOC (pH 7.4): 3.87; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)Index of Refraction: 1.576; (11)Molar Refractivity: 29.8 cm3; (12)Molar Volume: 89.9 cm3; (13)Surface Tension: 42.8 dyne/cm; (14)Density: 1.22 g/cm3; (15)Flash Point: 140.8 °C; (16)Enthalpy of Vaporization: 57.18 kJ/mol; (17)Boiling Point: 309.1 °C at 760 mmHg; (18)Vapour Pressure: 0.000357 mmHg at 25°C.
Uses of 2(1H)-Pyrimidinone,4-methyl-: it can be used to produce 2-chloro-4-methyl-pyrimidine. This reaction is a kind of Chlorination. It will need reagent phosphorus oxychloride. The yield is about 70%.
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You can still convert the following datas into molecular structure:
(1)SMILES: O=C1/N=C\C=C(/N1)C
(2)InChI: InChI=1/C5H6N2O/c1-4-2-3-6-5(8)7-4/h2-3H,1H3,(H,6,7,8)
(3)InChIKey: AHHHDTLXONDKQF-UHFFFAOYAH