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19198-80-2

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Basic Information
CAS No.: 19198-80-2
Name: 2,4-DIIODO-1H-IMIDAZOLE
Molecular Structure:
Molecular Structure of 19198-80-2 (2,4-DIIODO-1H-IMIDAZOLE)
Formula: C3H2I2N2
Molecular Weight: 319.871
Synonyms: 2,4-Diiodoimidazole;
Density: 3.043 g/cm3
Boiling Point: 385.583 °C at 760 mmHg
Flash Point: 186.994 °C
PSA: 28.68000
LogP: 1.61890
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Specification

The 1H-Imidazole,2,5-diiodo-, with the CAS registry number 19198-80-2, is also known as 2,4-Diiodoimidazole. It belongs to the product categories of Halides; Imidazoles & Benzimidazoles; Imidazoles & Benzimidazoles. This chemical's molecular formula is C3H2I2N2 and molecular weight is 319.8703. What's more, its IUPAC name is 2,5-Diiodo-1H-imidazole.

Physical properties about 1H-Imidazole,2,5-diiodo- are: (1)(1)ACD/LogP: 1.54; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.534; (4)ACD/LogD (pH 7.4): 1.53; (5)ACD/BCF (pH 5.5): 8.63; (6)ACD/BCF (pH 7.4): 8.54; (7)ACD/KOC (pH 5.5): 162.718; (8)ACD/KOC (pH 7.4): 161.026; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 28.68 Å2; (13)Index of Refraction: 1.792; (14)Molar Refractivity: 44.591 cm3; (15)Molar Volume: 105.125 cm3; (16)Polarizability: 17.677×10-24cm3; (17)Surface Tension: 77.831 dyne/cm; (18)Density: 3.043 g/cm3; (19)Flash Point: 186.994 °C; (20)Enthalpy of Vaporization: 63.441 kJ/mol; (21)Boiling Point: 385.583 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1c(nc([nH]1)I)I
(2) InChI: InChI=1/C3H2I2N2/c4-2-1-6-3(5)7-2/h1H,(H,6,7)
(3) InChIKey: VZSKMIVGFKARLQ-UHFFFAOYAJ