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109113-96-4

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Basic Information
CAS No.: 109113-96-4
Name: 2-(TRIFLUOROMETHYL)IMIDAZOL[1,2-A]PYRAZINE
Article Data: 12
Molecular Structure:
Molecular Structure of 109113-96-4 (2-(TRIFLUOROMETHYL)IMIDAZOL[1,2-A]PYRAZINE)
Formula: C7H4F3N3
Molecular Weight: 187.124
Synonyms: 2-(Trifluoromethyl)imidazo[1,2-a]pyrazine;2-(Trifluormethyl)imidazo[1,2-a]pyrazin;
Density: 1.52 g/cm3
Risk Codes: 43
Safety: 36/37
PSA: 30.19000
LogP: 1.74810
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Specification

The Imidazo[1,2-a]pyrazine,2-(trifluoromethyl)-, with the CAS registry number 109113-96-4, is also known as 2-(Trifluormethyl)imidazo[1,2-a]pyrazin. This chemical's molecular formula is C7H4F3N3 and molecular weight is 187.122. What's more, its systematic name is 2-(trifluoromethyl)imidazo[1,2-a]pyrazine. It is irritant.

Physical properties of Imidazo[1,2-a]pyrazine,2-(trifluoromethyl)- are: (1)ACD/LogP: 0.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.43; (4)ACD/BCF (pH 5.5): 1.25; (5)ACD/KOC (pH 5.5): 40.81; (6)#H bond acceptors: 3; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 0; (9)Polar Surface Area: 30.19 Å2; (10)Index of Refraction: 1.565; (11)Molar Refractivity: 39.91 cm3; (12)Molar Volume: 122.5 cm3; (13)Surface Tension: 37.9 dyne/cm; (14)Density: 1.52 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1nc2cnccn2c1
(2)InChI: InChI=1S/C7H4F3N3/c8-7(9,10)5-4-13-2-1-11-3-6(13)12-5/h1-4H
(3)InChIKey: GZOZMIOBJGXNBA-UHFFFAOYSA-N