2-AMINO-4,6-DIFLUOROBENZOTHIAZOLE

The 2-Amino-4,6-difluorobenzothiazole is an organic compound with the formula C₇H₄F₂N₂S. The systematic name of this chemical is 4,6-difluoro-1,3-benzothiazol-2-amine. With the CAS registry number 119256-40-5, it is also named as 2-Benzothiazolamine, 4,6-difluoro-. The product's categories are Benzothiazole; Amines; Thiazoles, Isothiazoles & Benzothiazoles; Thiazoles, Isothiazoles & Benzothiazoles; Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks; Thiazoles; ThiazolesHeterocyclic Building Blocks.

Physical properties about 2-Amino-4,6-difluorobenzothiazole are: (1)ACD/LogP: 2.03; (2)ACD/LogD (pH 5.5): 2.03; (3)ACD/LogD (pH 7.4): 2.03; (4)ACD/BCF (pH 5.5): 20.64; (5)ACD/BCF (pH 7.4): 20.65; (6)ACD/KOC (pH 5.5): 303.85; (7)ACD/KOC (pH 7.4): 304; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)Polar Surface Area: 44.37 Å²; (11)Index of Refraction: 1.691; (12)Molar Refractivity: 44.79 cm³; (13)Molar Volume: 116.9 cm³; (14)Polarizability: 17.75×10^-24cm³; (15)Surface Tension: 62.2 dyne/cm; (16)Density: 1.591 g/cm³; (17)Flash Point: 139.4 °C; (18)Enthalpy of Vaporization: 54.74 kJ/mol; (19)Boiling Point: 306.8 °C at 760 mmHg; (20)Vapour Pressure: 0.000754 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(F)cc2sc(nc12)N
(2)InChI: InChI=1/C7H4F2N2S/c8-3-1-4(9)6-5(2-3)12-7(10)11-6/h1-2H,(H2,10,11)
(3)InChIKey: DDKKXSCVPKDRRS-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C7H4F2N2S/c8-3-1-4(9)6-5(2-3)12-7(10)11-6/h1-2H,(H2,10,11)
(5)Std. InChIKey: DDKKXSCVPKDRRS-UHFFFAOYSA-N