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1028843-19-7

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Basic Information
CAS No.: 1028843-19-7
Name: 5-TRIFLUOROMETHYL-2H-PYRAZOL-3-YLAMINE
Molecular Structure:
Molecular Structure of 1028843-19-7 (5-TRIFLUOROMETHYL-2H-PYRAZOL-3-YLAMINE)
Formula: C4H4F3N3
Molecular Weight: 151.09
Synonyms: AKOS B025759;ART-CHEM-BB B025759;3-(TRIFLUOROMETHYL)-1H-PYRAZOL-5-AMINE;5-TRIFLUOROMETHYL-2H-PYRAZOL-3-YLAMINE
Density: 1.561 g/cm3
Melting Point: 90-92 °C
Boiling Point: 289.984 °C at 760 mmHg
Flash Point: 129.178 °C
Hazard Symbols: T
Risk Codes: 25-36-43
Safety: 26-36/37-45
PSA: 54.70000
LogP: 1.59190
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Specification

The 3-(Trifluoromethyl)-1H-pyrazol-5-amine is an organic compound with the formula C4H4F3N3. The systematic name of this chemical is 3-(trifluoromethyl)-1H-pyrazol-5-amine. With the CAS registry number 1028843-19-7, it is also named as 1H-pyrazol-3-amine, 5-(trifluoromethyl)-.

Physical properties about 3-(Trifluoromethyl)-1H-pyrazol-5-amine are: (1)ACD/LogP: 0.29 ; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 44; (5)ACD/KOC (pH 7.4): 44; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 54.7 Å2; (10)Index of Refraction: 1.49; (11)Molar Refractivity: 27.993 cm3; (12)Molar Volume: 96.77 cm3; (13)Polarizability: 11.097×10-24cm3; (14)Surface Tension: 40.464 dyne/cm; (15)Density: 1.561 g/cm3; (16)Flash Point: 129.178 °C; (17)Enthalpy of Vaporization: 52.932 kJ/mol; (18)Boiling Point: 289.984 °C at 760 mmHg; (19)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cc(N)nn1
(2)InChI: InChI=1/C4H4F3N3/c5-4(6,7)2-1-3(8)10-9-2/h1H,(H3,8,9,10)
(3)InChIKey: WVORIWCOSAWJJE-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C4H4F3N3/c5-4(6,7)2-1-3(8)10-9-2/h1H,(H3,8,9,10)
(5)Std. InChIKey: WVORIWCOSAWJJE-UHFFFAOYSA-N