1H-Pyrazol-3-amine,4-(trifluoromethyl)- (1056139-87-7)

The 4-Trifluoromethyl-1H-pyrazol-3-amine with cas registry number of 1056139-87-7, whose systematic name is 4-(trifluoromethyl)-1H-pyrazol-3-amine. And it is also named 4-Trifluoromethyl-1H-pyrazol-3-amine.

Physical properties of 4-Trifluoromethyl-1H-pyrazol-3-amine: (1)ACD/LogP: 1.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.58; (4)ACD/LogD (pH 7.4): 1.58; (5)ACD/BCF (pH 5.5): 9.33; (6)ACD/BCF (pH 7.4): 9.33; (7)ACD/KOC (pH 5.5): 172.15; (8)ACD/KOC (pH 7.4): 172.16; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 54.7 Å²; (13)Index of Refraction: 1.49; (14)Molar Refractivity: 27.99 cm³; (15)Molar Volume: 96.7 cm³; (16)Polarizability: 11.09×10^-24cm³; (17)Surface Tension: 40.4 dyne/cm; (18)Enthalpy of Vaporization: 52.28 kJ/mol; (19)Vapour Pressure: 0.00309 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES:FC(F)(F)c1cnnc1N;
(2)InChI:InChI=1/C4H4F3N3/c5-4(6,7)2-1-9-10-3(2)8/h1H,(H3,8,9,10);
(3)InChIKey:KBVOILKOLGWPBG-UHFFFAOYAT;
(4)Std. InChI:InChI=1S/C4H4F3N3/c5-4(6,7)2-1-9-10-3(2)8/h1H,(H3,8,9,10);
(5)Std. InChIKey:KBVOILKOLGWPBG-UHFFFAOYSA-N.