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CAS No.: | 259675-83-7 |
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Name: | 2-AMINO-3,5,6-TRIFLUORO-PYRIDINE-4-CARBOXAMIDE |
Molecular Structure: | |
Formula: | C6H4F3N3O |
Molecular Weight: | 191.11 |
Synonyms: | -; 2-amino-3,5,6-trifluoropyridine-4-carboxamide |
Density: | 1.643 g/cm3 |
Boiling Point: | 183.7 °C at 760 mmHg |
Flash Point: | 64.9 °C |
PSA: | 82.00000 |
LogP: | 1.46150 |
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The 4-Pyridinecarboxamide,2-amino-3,5,6-trifluoro-, with the CAS registry number 259675-83-7, is also known as 2-Amino-3,5,6-trifluoro-pyridine-4-carboxamide. It belongs to the product category of Pyridine. This chemical's molecular formula is C6H4F3N3O and molecular weight is 191.11. What's more, its systematic name is 2-Amino-3,5,6-trifluoropyridine-4-carboxamide.
Physical properties about 4-Pyridinecarboxamide,2-amino-3,5,6-trifluoro are: (1)ACD/LogP: 1.35; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.35; (4)ACD/LogD (pH 7.4): 1.35; (5)ACD/BCF (pH 5.5): 6.25; (6)ACD/BCF (pH 7.4): 6.25; (7)ACD/KOC (pH 5.5): 129.15; (8)ACD/KOC (pH 7.4): 129.15; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 36.44 Å2; (13)Index of Refraction: 1.558; (14)Molar Refractivity: 37.49 cm3; (15)Molar Volume: 116.2 cm3; (16)Polarizability: 14.86×10-24cm3; (17)Surface Tension: 59.6 dyne/cm; (18)Density: 1.643 g/cm3; (19)Flash Point: 64.9 °C; (20)Enthalpy of Vaporization: 41.99 kJ/mol; (21)Boiling Point: 183.7 °C at 760 mmHg; (22) Vapour Pressure: 0.76 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Fc1c(C(=O)N)c(F)c(F)nc1N
(2) InChI: InChI=1/C6H4F3N3O/c7-2-1(6(11)13)3(8)5(10)12-4(2)9/h(H2,10,12)(H2,11,13)
(3) InChIKey: QPNDGATZXOVQDL-UHFFFAOYAC