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2,4-Dichloro-8-fluoroquinazoline

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Name

2,4-Dichloro-8-fluoroquinazoline

EINECS N/A
CAS No. 959237-64-0 Density 1.571 g/cm3
PSA 25.78000 LogP 3.07570
Solubility N/A Melting Point N/A
Formula C8H3Cl2FN2 Boiling Point 277.3 °C at 760 mmHg
Molecular Weight 217.03 Flash Point 121.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 959237-64-0 (2,4-DICHLORO-8-FLUORO-QUINAZOLINE) Hazard Symbols N/A
Synonyms

Quinazoline,2,4-dichloro-8-fluoro-;

Article Data 3

2,4-Dichloro-8-fluoroquinazoline Specification

The IUPAC name of this chemical is 2,4-Dichloro-8-fluoroquinazoline. With the CAS registry number 959237-64-0, it is also named as quinazoline, 2,4-dichloro-8-fluoro-. In addition, the molecular formula is C8H3Cl2FN2 and the molecular weight is 217.03. It should be stored in a cool and dry place.

Physical properties about this chemical are: (1)ACD/LogP: 2.80; (2)ACD/LogD (pH 5.5): 2.8; (3)ACD/LogD (pH 7.4): 2.8; (4)ACD/BCF (pH 5.5): 78.6; (5)ACD/BCF (pH 7.4): 78.6; (6)ACD/KOC (pH 5.5): 791.34; (7)ACD/KOC (pH 7.4): 791.34; (8)#H bond acceptors: 2; (9)Polar Surface Area: 25.78 Å2; (10)Index of Refraction: 1.644; (11)Molar Refractivity: 50.06 cm3; (12)Molar Volume: 138.1 cm3; (13)Polarizability: 19.84 ×10-24cm3; (14)Surface Tension: 56.2 dyne/cm; (15)Density: 1.571 g/cm3; (16)Flash Point: 121.5 °C; (17)Enthalpy of Vaporization: 49.51 kJ/mol; (18)Boiling Point: 277.3 °C at 760 mmHg; (19)Vapour Pressure: 0.00772 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2nc(Cl)nc1c2cccc1F
(2)InChI: InChI=1/C8H3Cl2FN2/c9-7-4-2-1-3-5(11)6(4)12-8(10)13-7/h1-3H
(3)InChIKey: VXSUTXKJWJUPLJ-UHFFFAOYAU

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