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3-Pyridinecarbonitrile,2,4-diiodo-

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Name

3-Pyridinecarbonitrile,2,4-diiodo-

EINECS N/A
CAS No. 827616-54-6 Density 2.68 g/cm3
PSA 36.68000 LogP 2.16248
Solubility N/A Melting Point N/A
Formula C6H2I2N2 Boiling Point 404.9 °C at 760 mmHg
Molecular Weight 355.904 Flash Point 198.7 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 827616-54-6 (2,4-DIIODOPYRIDINE-3-CARBONITRILE) Hazard Symbols N/A
Synonyms

3-Cyano-2,4-diiodopyridine;

Article Data 2

3-Pyridinecarbonitrile,2,4-diiodo- Specification

The 3-Pyridinecarbonitrile,2,4-diiodo-, with the CAS registry number 827616-54-6, is also known as 3-Cyano-2,4-diiodopyridine. It belongs to the product category of Heterocyclic Compounds. This chemical's molecular formula is C6H2I2N2 and molecular weight is 355.9024. What's more, its systematic name is called 2,4-Diiodopyridine-3-carbonitrile.

Physical properties about 3-Pyridinecarbonitrile,2,4-diiodo- are: (1)ACD/LogP: 1.71; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.71; (4)ACD/LogD (pH 7.4): 1.71; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 36.68 Å2; (9)Index of Refraction: 1.769; (10)Molar Refractivity: 54.96 cm3; (11)Molar Volume: 132.3 cm3; (12)Polarizability: 21.78×10-24 cm3; (13)Surface Tension: 80.5 dyne/cm; (14)Density: 2.68 g/cm3; (15)Flash Point: 198.7 °C; (16)Enthalpy of Vaporization: 65.64 kJ/mol; (17)Boiling Point: 404.9 °C at 760 mmHg; (18)Vapour Pressure: 9.13E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: N#Cc1c(I)ccnc1I
(2) InChI: InChI=1/C6H2I2N2/c7-5-1-2-10-6(8)4(5)3-9/h1-2H
(3) InChIKey: INCJBCHICXNSJJ-UHFFFAOYAX

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