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| CAS No.: | 18260-60-1 |
|---|---|
| Name: | 2,4,6-TRIFLUORO-5-METHYLPYRIMIDINE |
| Article Data: | 3 |
| Molecular Structure: | |
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| Formula: | C5H3F3N2 |
| Molecular Weight: | 148.087 |
| Synonyms: | 2,4,6-Trifluoro-5-methylpyrimidine; |
| Density: | 1.413 g/cm3 |
| Boiling Point: | 210.9 °C at 760 mmHg |
| Flash Point: | 81.4 °C |
| PSA: | 25.78000 |
| LogP: | 1.20230 |
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- Total:11 Page 1 of 1 1
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Specification
This chemical is called Pyrimidine, 2,4,6-trifluoro-5-methyl-, and its systematic name is 2,4,6-trifluoro-5-methylpyrimidine. With the molecular formula of C5H3F3N2, its molecular weight is 148.09. The CAS registry number of this chemical is 18260-60-1. Additionally, its product category is Pyrimidine.
Other characteristics of the Pyrimidine, 2,4,6-trifluoro-5-methyl- can be summarised as followings: (1)ACD/LogP: 0.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.62; (4)ACD/LogD (pH 7.4): 0.62; (5)ACD/BCF (pH 5.5): 1.75; (6)ACD/BCF (pH 7.4): 1.75; (7)ACD/KOC (pH 5.5): 51.86; (8)ACD/KOC (pH 7.4): 51.86; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 25.78 Å2; (13)Index of Refraction: 1.433; (14)Molar Refractivity: 27.24 cm3; (15)Molar Volume: 104.7 cm3; (16)Polarizability: 10.79×10-24cm3; (17)Surface Tension: 34.8 dyne/cm; (18)Density: 1.413 g/cm3; (19)Flash Point: 81.4 °C; (20)Enthalpy of Vaporization: 42.9 kJ/mol; (21)Boiling Point: 210.9 °C at 760 mmHg; (22)Vapour Pressure: 0.272 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Fc1nc(F)nc(F)c1C
2.InChI: InChI=1/C5H3F3N2/c1-2-3(6)9-5(8)10-4(2)7/h1H3
3.InChIKey: AZVALKSFVWAVOL-UHFFFAOYAI