CAS No.13349-90-1,1-(2,2,2-Trifluoroethyl)piperazine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	13349-90-1
Name:	1-(2,2,2-Trifluoroethyl)piperazine
Article Data:	10

Formula:	C₆H₁₁F₃N₂
Molecular Weight:	168.162
Synonyms:	1-(2,2,2-Trifluoroethyl)piperazine;4-(2,2,2-Trifluoroethyl)piperazine;N-(2,2,2-Trifluoroethyl)piperazine;
Density:	1.14 g/cm³
Boiling Point:	146.529 °C at 760 mmHg
Flash Point:	42.42 °C
PSA:	15.27000
LogP:	0.72060

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Specification

The Piperazine,1-(2,2,2-trifluoroethyl)-, with CAS registry number of 13349-90-1, is also known as (2,2,2-Trifluoroethyl)piperazine. Its systematic name is 1-(2,2,2-Trifluoroethyl)piperazine . Its molecular formula is C₆H₁₁F₃N₂, and its molecular weight is 168.1601.

Physical properties about Piperazine,1-(2,2,2-trifluoroethyl)- are: (1) ACD/LogP: 0.18; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): -2; (4) ACD/LogD (pH 7.4): 0; (5) ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1; (7) ACD/KOC (pH 7.4): 6; (8) # H bond acceptors: 2; (9) #H bond donors: 1; (10) # Freely Rotating Bonds: 1; (11) Polar Surface Area: 15.27 Å²; (12) Index of Refraction: 1.392; (13) Molar Refractivity: 35.145 cm³; (14) Molar Volume: 147.514 cm³; (15) Polarizability: 13.933×10^-24 cm³; (16) Surface Tension: 21.866 dyne/cm; (17) Density: 1.14 g/cm³; (18) Flash Point: 42.42 °C; (19) Enthalpy of Vaporization: 38.354 kJ/mol; (20) Boiling Point: 146.529 °C at 760 mmHg; (21) Vapour Pressure: 4.617 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(F)CN1CCNCC1
(2) InChI: InChI=1/C6H11F3N2/c7-6(8,9)5-11-3-1-10-2-4-11/h10H,1-5H2
(3) InChIKey: GFPOCAYEKCWFPD-UHFFFAOYAI