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CAS No.: | 247564-55-2 |
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Name: | 4,7-DIFLUOROINDOLE |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C8H5F2N |
Molecular Weight: | 153.1288 |
Synonyms: | 4,7-Difluoro-1H-indole;4,7-Difluoroindole; |
EINECS: | 200-258-5 |
Density: | 1.388 g/cm3 |
Boiling Point: | 261 °C at 760 mmHg |
Flash Point: | 111.7 °C |
Hazard Symbols: | Xi |
PSA: | 15.79000 |
LogP: | 2.44610 |
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The 1H-Indole,4,7-difluoro-, with the CAS registry number 247564-55-2, is also known as 4,7-Difluoroindole. It belongs to the product categories of Halide; Indole; Indole/ indoline/ oxindole; Indoles. This chemical's molecular formula is C8H5F2N and molecular weight is 153.1288. Its systematic name is called 4,7-difluoro-1H-indole. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties of 1H-Indole,4,7-difluoro-: (1)ACD/LogP: 2.31; (2)ACD/LogD (pH 5.5): 2.31; (3)ACD/LogD (pH 7.4): 2.31; (4)ACD/BCF (pH 5.5): 33.75; (5)ACD/BCF (pH 7.4): 33.75; (6)ACD/KOC (pH 5.5): 432.09; (7)ACD/KOC (pH 7.4): 432.09; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)Index of Refraction: 1.615; (11)Molar Refractivity: 38.51 cm3; (12)Molar Volume: 110.2 cm3; (13)Surface Tension: 44.5 dyne/cm; (14)Density: 1.388 g/cm3; (15)Flash Point: 111.7 °C; (16)Enthalpy of Vaporization: 47.86 kJ/mol; (17)Boiling Point: 261 °C at 760 mmHg; (18)Vapour Pressure: 0.0192 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(F)c2c1ccn2
(2)InChI: InChI=1/C8H5F2N/c9-6-1-2-7(10)8-5(6)3-4-11-8/h1-4,11H
(3)InChIKey: WXDUAQYBARJXOQ-UHFFFAOYAN