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Quinoxyfen

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Name

Quinoxyfen

EINECS 602-997-3
CAS No. 124495-18-7 Density 1.43 g/cm3
PSA 22.12000 LogP 5.47300
Solubility 0.12 mg l-1 (20 °C) Melting Point 105-106°
Formula C15H8Cl2FNO Boiling Point 423.153 °C at 760 mmHg
Molecular Weight 308.139 Flash Point 209.716 °C
Transport Information UN 3077 9/PG 3 Appearance liquid
Safety 24-37-46-60-61 Risk Codes 43-50/53
Molecular Structure Molecular Structure of 124495-18-7 (QUINOXYFEN) Hazard Symbols IrritantXi, DangerousN
Synonyms

5,7-Dichloro-4-(4-fluorophenoxy)quinoline;

Article Data 4

Quinoxyfen Specification

The Quinoxyfen, with the CAS registry number of 124495-18-7, is also known as Quinoline, 5,7-dichloro-4-(4-fluorophenoxy)-. This chemical's molecular formula is C15H8Cl2FNO and molecular weight is 308.1345. What's more, its IUPAC name is 5, 7-Dichloro-4-(4-fluorophenoxy)quinoline. Besides, it should be stored at 0-6 °C.

Physical properties about Quinoxyfen are: (1)ACD/LogP: 5.93; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 22.12 Å2; (7)Index of Refraction: 1.648; (8)Molar Refractivity: 78.41 cm3; (9)Molar Volume: 215.4 cm3; (10)Surface Tension: 50.7 dyne/cm; (11)Density: 1.43 g/cm3; (12)Flash Point: 209.7 °C; (13)Enthalpy of Vaporization: 65.12 kJ/mol; (14)Boiling Point: 423.2 °C at 760 mmHg; (15)Vapour Pressure: 5.62E-07 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause sensitisation by skin contact. In addition, this chemical is very toxic to aquatic organisms, and it may cause long-term adverse effects in the aquatic environment. During using it, wear suitable gloves. If swallowed, seek medical advice immediately. Besides, this material and its container must be disposed of as hazardous waste.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc3ccc(Oc1c2c(Cl)cc(Cl)cc2ncc1)cc3
(2) InChI: InChI=1/C15H8Cl2FNO/c16-9-7-12(17)15-13(8-9)19-6-5-14(15)20-11-3-1-10(18)2-4-11/h1-8H
(3) InChIKey: WRPIRSINYZBGPK-UHFFFAOYAE

The toxicity data of Quinoxyfen is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 500mg/kg (500mg/kg) BEHAVIORAL: MUSCLE WEAKNESS National Technical Information Service. Vol. OTS0545018,

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