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CAS No.: | 156647-96-0 |
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Name: | 4-HYDROXY-6-METHYLPYRIMIDINE |
Article Data: | 13 |
Molecular Structure: | |
Formula: | C5H6N2O |
Molecular Weight: | 110.115 |
Synonyms: | 6-Methylpyrimidin-4(1H)-one;6-methylpyrimidin-4(3H)-one;6-methylpyrimidin-4-ol;6-Methyl-pyrimidin-4-ol; |
EINECS: | 222-543-4 |
Density: | 1.2±0.1 g/cm3 |
Boiling Point: | 242.1±20.0 °C at 760 mmHg |
Flash Point: | 100.2±21.8 °C |
PSA: | 46.01000 |
LogP: | 0.49060 |
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The 4-Pyrimidinol,6-methyl- is an organic compound with the formula C5H6N2O. The systematic name of this chemical is 6-Methylpyrimidin-4(3H)-one. With the CAS registry number 156647-96-0, it is also named as 4(3H)-Pyrimidinone, 6-methyl-. The product's category is Pyrimidine. Besides, its molecular weight is 110.11.
Physical properties about 4-Pyrimidinol,6-methyl- are: (1)ACD/LogP: -0.79; (2)ACD/LogD (pH 5.5): -0.79; (3)ACD/LogD (pH 7.4): -0.79; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 8.86; (7)ACD/KOC (pH 7.4): 8.78; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)Polar Surface Area: 32.67 Å2; (11)Index of Refraction: 1.576; (12)Molar Refractivity: 29.8 cm3; (13)Molar Volume: 89.9 cm3; (14)Polarizability: 11.81×10-24 cm3; (15)Surface Tension: 42.8 dyne/cm; (16)Density: 1.22 g/cm3; (17)Flash Point: 70 °C; (18)Enthalpy of Vaporization: 42.83 kJ/mol; (19)Boiling Point: 192.1 °C at 760 mmHg; (20)Vapour Pressure: 0.496 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C5H6N2O/c1-4-2-5(8)7-3-6-4/h2-3H,1H3,(H,6,7,8)
(2)InChIKey: LHRIUKSRPHFASO-UHFFFAOYAG
(3)Std. InChI: InChI=1S/C5H6N2O/c1-4-2-5(8)7-3-6-4/h2-3H,1H3,(H,6,7,8)
(4)Std. InChIKey: LHRIUKSRPHFASO-UHFFFAOYSA-N