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CAS No.: | 18529-03-8 |
---|---|
Name: | 7-FLUORO-2-METHYL-QUINOLIN-4-OL |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C10H8FNO |
Molecular Weight: | 177.178 |
Synonyms: | 7-Fluoro-2-methyl-quinolin-4-ol;7-Fluoro-4-hydroxy-2-methylquinoline; |
Density: | 1.228 g/cm3 |
Boiling Point: | 271.975 °C at 760 mmHg |
Flash Point: | 118.286 °C |
Hazard Symbols: | Xn |
Risk Codes: | 22-41 |
Safety: | 26-39 |
PSA: | 33.12000 |
LogP: | 2.38790 |
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The CAS register number of 4-Quinolinol,7-fluoro-2-methyl- is 18529-03-8. It also can be called as 7-Fluoro-4-hydroxy-2-methylquinoline and the systematic name about this chemical is 7-fluoro-2-methylquinolin-4(1H)-one. The molecular formula about this chemical is C10H8FNO and the molecular weight is 177.18.
Physical properties about 4-Quinolinol,7-fluoro-2-methyl- are: (1)ACD/LogP: 0.96; (2)ACD/LogD (pH 5.5): 4; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 307; (5)ACD/BCF (pH 7.4): 307; (6)ACD/KOC (pH 5.5): 2097; (7)ACD/KOC (pH 7.4): 2097; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)Polar Surface Area: 29.1 Å2; (11)Index of Refraction: 1.554; (12)Molar Refractivity: 46.207 cm3; (13)Molar Volume: 144.281 cm3; (14)Polarizability: 18.318x10-24cm3; (15)Surface Tension: 37.583 dyne/cm; (16)Density: 1.228 g/cm3; (17)Flash Point: 118.286 °C; (18)Enthalpy of Vaporization: 51.024 kJ/mol; (19)Boiling Point: 271.975 °C at 760 mmHg; (20)Vapour Pressure: 0.006 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc2c(c1)N/C(=C\C2=O)C
(2)InChI: InChI=1/C10H8FNO/c1-6-4-10(13)8-3-2-7(11)5-9(8)12-6/h2-5H,1H3,(H,12,13)
(3)InChIKey: DGZLIRLGDGAYDG-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C10H8FNO/c1-6-4-10(13)8-3-2-7(11)5-9(8)12-6/h2-5H,1H3,(H,12,13)
(5)Std. InChIKey: DGZLIRLGDGAYDG-UHFFFAOYSA-N