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Name |
Ethanone,1-(4,6-dimethyl-2-pyrimidinyl)- |
EINECS | N/A |
CAS No. | 64571-50-2 | Density | 1.073 g/cm3 |
PSA | 42.85000 | LogP | 1.29600 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H10N2O | Boiling Point | 288.423 °C at 760 mmHg |
Molecular Weight | 150.18 | Flash Point | 132.592 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Acetyl-4,6-dimethylpyrimidine;1-(4,6-Dimethylpyrimidin-2-yl)ethanone; |
Article Data | 6 |
The Ethanone,1-(4,6-dimethyl-2-pyrimidinyl)-, with the CAS registry number 64571-50-2, is also known as 2-Acetyl-4,6-dimethylpyrimidine. It belongs to the product categories of Pyrimidine; Acetylgroup. This chemical's molecular formula is C8H10N2O and molecular weight is 150.1778. What's more, its IUPAC name and systematic name are the same which is called 1-(4,6-Dimethylpyrimidin-2-yl)ethanone.
Physical properties about Ethanone,1-(4,6-dimethyl-2-pyrimidinyl)-: (1)ACD/LogP: 0.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 32; (8)ACD/KOC (pH 7.4): 32; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 42.85 Å2; (13)Index of Refraction: 1.514; (14)Molar Refractivity: 42.113 cm3; (15)Molar Volume: 139.962 cm3; (16)Surface Tension: 41.875 dyne/cm; (17)Density: 1.073 g/cm3; (18)Flash Point: 132.592 °C; (19)Enthalpy of Vaporization: 52.766 kJ/mol; (20)Boiling Point: 288.423 °C at 760 mmHg; (21)Vapour Pressure: 0.002 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Cc1cc(C)nc(n1)C(=O)C
(2) InChI: InChI=1/C8H10N2O/c1-5-4-6(2)10-8(9-5)7(3)11/h4H,1-3H3
(3) InChIKey: WRNFJVGKPVGXBI-UHFFFAOYAO