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5876-52-8

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Basic Information
CAS No.: 5876-52-8
Name: 5,6-DIIODOBENZO(1,3)DIOXOLE
Article Data: 11
Molecular Structure:
Molecular Structure of 5876-52-8 (5,6-DIIODOBENZO(1,3)DIOXOLE)
Formula: C7H4I2O2
Molecular Weight: 373.917
Synonyms: Benzene,1,2-diiodo-4,5-(methylenedioxy)- (7CI,8CI);5,6-Diiodo-1,3-benzodioxole;5,6-Diiodobenzo[d][1,3]dioxole;
Density: 2.583 g/cm3
Boiling Point: 321.5 °C at 760 mmHg
Flash Point: 148.3 °C
Hazard Symbols: IrritantXi
PSA: 18.46000
LogP: 2.62450
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Specification

The 1,3-Benzodioxole,5,6-diiodo- is an organic compound with the formula C7H4I2O2. The systematic name of this chemical is 5,6-Diiodo-1,3-benzodioxole. With the CAS registry number 5876-52-8, it is also named as 5,6-Diiodobenzo[d][1,3]dioxole. Besides, its molecular weight is 373.91.

Physical properties about 1,3-Benzodioxole,5,6-diiodo- are: (1)ACD/LogP: 4.32; (2)ACD/LogD (pH 5.5): 4.32; (3)ACD/LogD (pH 7.4): 4.32; (4)#H bond acceptors: 2; (5)Polar Surface Area: 18.46 Å2; (6)Index of Refraction: 1.737; (7)Molar Refractivity: 58.22 cm3; (8)Molar Volume: 144.7 cm3; (9)Polarizability: 23.08×10-24 cm3; (10)Surface Tension: 66.8 dyne/cm; (11)Density: 2.583 g/cm3; (12)Flash Point: 148.3 °C; (13)Enthalpy of Vaporization: 54.09 kJ/mol; (14)Boiling Point: 321.5 °C at 760 mmHg; (15)Vapour Pressure: 0.000556 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C7H4I2O2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-2H,3H2
(2)InChIKey: BXUOIEPSOIEXIN-UHFFFAOYAY
(3)Std. InChI: InChI=1S/C7H4I2O2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-2H,3H2
(4)Std. InChIKey: BXUOIEPSOIEXIN-UHFFFAOYSA-N