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CAS No.: | 266312-20-3 |
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Name: | 2,3,5-TRIFLUOROPYRIDINE-4-CARBOXALDEHYDE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C6H2F3NO |
Molecular Weight: | 161.083 |
Synonyms: | 2,3,5-Trifluoro-4-pyridinecarboxaldehyde; |
Density: | 1.506 g/cm3 |
Boiling Point: | 181.6 °C at 760 mmHg |
Flash Point: | 63.6 °C |
PSA: | 29.96000 |
LogP: | 1.31140 |
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The 2,3,5-Trifluoro-4-pyridinecarboxaldehyde with its cas register number is 266312-20-3. It also can be called as 4-Pyridinecarboxaldehyde,2,3,5-trifluoro- and the Systematic name about this chemical is 2,3,5-trifluoropyridine-4-carbaldehyde. It belongs to the Halide.
Physical properties about 2,3,5-Trifluoro-4-pyridinecarboxaldehyde are: (1)ACD/LogP: 1.03; (2)ACD/LogD (pH 5.5): 1.03; (3)ACD/LogD (pH 7.4): 1.03; (4)ACD/BCF (pH 5.5): 3.57; (5)ACD/BCF (pH 7.4): 3.57; (6)ACD/KOC (pH 5.5): 86.6; (7)ACD/KOC (pH 7.4): 86.6; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 29.96Å2; (11)Index of Refraction: 1.492; (12)Molar Refractivity: 31.07 cm3; (13)Molar Volume: 106.9 cm3; (14)Polarizability: 12.32x10-24cm3; (15)Surface Tension: 39.3 dyne/cm; (16)Enthalpy of Vaporization: 41.78 kJ/mol; (17)Vapour Pressure: 0.847 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(C=O)c(F)cnc1F
(2)InChI: InChI=1/C6H2F3NO/c7-4-1-10-6(9)5(8)3(4)2-11/h1-2H
(3)InChIKey: WKAJBRZTHRZEAU-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C6H2F3NO/c7-4-1-10-6(9)5(8)3(4)2-11/h1-2H
(5)Std. InChIKey: WKAJBRZTHRZEAU-UHFFFAOYSA-N