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CAS No.: | 908600-75-9 |
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Name: | 7-Fluoro-1H-Indole-6-carboxylic acid |
Molecular Structure: | |
Formula: | C9H6FNO2 |
Molecular Weight: | 179.15 |
Synonyms: | 7-fluoro-1H-indole-6-carboxylic acid; |
Density: | 1.51 g/cm3 |
Boiling Point: | 411.458 °C at 760 mmHg |
Flash Point: | 202.643 °C |
PSA: | 53.09000 |
LogP: | 2.00520 |
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The 7-Fluoro-1H-Indole-6-carboxylic acid is the organic compound with the formula C9H6FNO2. With the CAS registry number 908600-75-9, its systematic name is 7-fluoro-1H-indole-6-carboxylic acid.
Physical properties of 7-Fluoro-1H-Indole-6-carboxylic acid: (1)ACD/LogP: 1.94; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 1; (5)Index of Refraction: 1.692; (6)Molar Refractivity: 45.452 cm3; (7)Molar Volume: 118.611 cm3; (8)Surface Tension: 67.489 dyne/cm; (9)Density: 1.51 g/cm3; (10)Flash Point: 202.643 °C; (11)Enthalpy of Vaporization: 70.005 kJ/mol; (12)Boiling Point: 411.458 °C at 760 mmHg; (13)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1ccc2c(c1F)ncc2
(2)InChI: InChI=1/C9H6FNO2/c10-7-6(9(12)13)2-1-5-3-4-11-8(5)7/h1-4,11H,(H,12,13)
(3)InChIKey: LJUIVYSSKFZMBU-UHFFFAOYAZ