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Cas Database |
| Name |
1H-Indole-1-aceticacid, 5-fluoro- |
EINECS | 604-604-1 |
| CAS No. | 796071-90-4 | Density | 1.33 g/cm3 |
| PSA | 42.23000 | LogP | 1.86500 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C10H8FNO2 | Boiling Point | 388.5 °C at 760 mmHg |
| Molecular Weight | 193.177 | Flash Point | 188.7 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
(5-Fluoro-1H-indol-1-yl)acetic acid; |
Article Data | 6 |
1H-Indole-1-aceticacid, 5-fluoro- Specification
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
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