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4-Quinolinol,5,7-dichloro-2-(trifluoromethyl)-

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Name

4-Quinolinol,5,7-dichloro-2-(trifluoromethyl)-

EINECS N/A
CAS No. 59108-13-3 Density 1.593 g/cm3
PSA 33.12000 LogP 4.26600
Solubility N/A Melting Point 230°C (dec.)
Formula C10H4Cl2F3NO Boiling Point 296.3 °C at 760 mmHg
Molecular Weight 282.049 Flash Point 133 °C
Transport Information N/A Appearance N/A
Safety 37/39 -26 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 59108-13-3 (5,7-DICHLORO-4-HYDROXY-2-(TRIFLUOROMETHYL)QUINOLINE) Hazard Symbols IrritantXi
Synonyms

5,7-dichloro-2-(trifluoromethyl)-1H-quinolin-4-one

 

4-Quinolinol,5,7-dichloro-2-(trifluoromethyl)- Specification

This chemical is called 4-Quinolinol,5,7-dichloro-2-(trifluoromethyl)-, and its systematic name is 5,7-dichloro-2-(trifluoromethyl)quinolin-4(1H)-one. With the molecular formula of C10H4Cl2F3NO, its molecular weight is 282.05. The CAS registry number of this chemical is 59108-13-3. Additionally, its product categories are Quinoline & Isoquinoline. This chemical should be stored sealed in the cool and dry place, away from the water.

Other characteristics of the 4-Quinolinol,5,7-dichloro-2-(trifluoromethyl)- can be summarised as followings: (1)ACD/LogP: 6.35; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.35; (4)ACD/LogD (pH 7.4): 6.35; (5)ACD/BCF (pH 5.5): 39158.83; (6)ACD/BCF (pH 7.4): 39158.83; (7)ACD/KOC (pH 5.5): 67473.1; (8)ACD/KOC (pH 7.4): 67473.1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.546; (14)Molar Refractivity: 56.08 cm3; (15)Molar Volume: 177 cm3; (16)Polarizability: 22.23×10-24cm3; (17)Surface Tension: 40.9 dyne/cm; (18)Density: 1.593 g/cm3; (19)Flash Point: 133 °C; (20)Enthalpy of Vaporization: 53.61 kJ/mol; (21)Boiling Point: 296.3 °C at 760 mmHg; (22)Vapour Pressure: 0.00144 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: FC(F)(F)C\2=C\C(=O)c1c(Cl)cc(Cl)cc1N/2
2.InChI: InChI=1/C10H4Cl2F3NO/c11-4-1-5(12)9-6(2-4)16-8(3-7(9)17)10(13,14)15/h1-3H,(H,16,17)
3.InChIKey: UPYWRJPYAKQWLV-UHFFFAOYAX

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