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CAS No.: | 796071-90-4 |
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Name: | (5-FLUOROINDOL-1-YL)ACETIC ACID |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C10H8FNO2 |
Molecular Weight: | 193.177 |
Synonyms: | (5-Fluoro-1H-indol-1-yl)acetic acid; |
EINECS: | 604-604-1 |
Density: | 1.33 g/cm3 |
Boiling Point: | 388.5 °C at 760 mmHg |
Flash Point: | 188.7 °C |
PSA: | 42.23000 |
LogP: | 1.86500 |
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The 1H-Indole-1-aceticacid, 5-fluoro-, with the CAS registry number 796071-90-4, is also known as (5-Fluoro-1H-indol-1-yl)acetic acid. This chemical's molecular formula is C10H8FNO2 and molecular weight is 193.17. Its systematic name is called 2-(5-fluoroindol-1-yl)acetic acid.
Physical properties of 1H-Indole-1-aceticacid, 5-fluoro-: (1)ACD/LogP: 1.97; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Index of Refraction: 1.592; (6)Molar Refractivity: 49.06 cm3; (7)Molar Volume: 144.7 cm3; (8)Surface Tension: 45.7 dyne/cm; (9)Density: 1.33 g/cm3; (10)Flash Point: 188.7 °C; (11)Enthalpy of Vaporization: 67.26 kJ/mol; (12)Boiling Point: 388.5 °C at 760 mmHg; (13)Vapour Pressure: 9.91E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc2c(ccn2CC(=O)O)cc1F
(2)InChI: InChI=1/C10H8FNO2/c11-8-1-2-9-7(5-8)3-4-12(9)6-10(13)14/h1-5H,6H2,(H,13,14)
(3)InChIKey: HWMIWHZKBNDAMQ-UHFFFAOYAP