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54829-48-0

Basic Information
CAS No.: 54829-48-0
Name: 2-Iodofuran
Article Data: 1
Molecular Structure:
Molecular Structure of 54829-48-0 (2-Iodofuran)
Formula: C4H3IO
Molecular Weight: 193.972
Synonyms: 2-Furyliodide;2-Iodofuran;
Density: 2.057 g/cm3
Melting Point: 242-244 °C
Boiling Point: 152.004 °C at 760 mmHg
Flash Point: 45.731 °C
PSA: 13.14000
LogP: 1.88420
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  • 54829-48-0  CAS NO.54829-48-0

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Specification

The 2-Iodofuran with its cas register number is 54829-48-0. It also can be called as Furan, 2-iodo- and the Systematic name about this chemical is 2-iodofuran. It belongs to the Furans.

Physical properties about 2-Iodofuran are: (1)ACD/LogP: 3.02; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 40; (5)ACD/BCF (pH 7.4): 40; (6)ACD/KOC (pH 5.5): 488; (7)ACD/KOC (pH 7.4): 488; (8)#H bond acceptors: 1; (9)Polar Surface Area: 13.14Å2; (10)Index of Refraction: 1.582; (11) Molar Refractivity: 31.459 cm3; (12)Molar Volume: 94.301 cm3; (13) Polarizability: 12.471x10-24cm3; (14)Surface Tension: 39.804 dyne/cm; (15)Enthalpy of Vaporization: 37.282 kJ/mol; (16)Vapour Pressure: 4.56 mmHg at 25°C

Preparation: this chemical can be prepared by furan-2-yl-lithium. This reaction will need reagent iodine and solvent tetrahydrofuran. The reaction temperature of -40 ℃. The yield is about 70 %.

Uses of 2-Iodofuran: it can be used to produce 2,2'-ethynediyl-bis-furan with ethyne at temperature of 20 ℃. This reaction is a kind of Alkylation. It will need reagent CuI, Et2N and catalyst [(C6H5)3P]2PdCl2 with reaction time of 6 hour(s). The yield is about 75%.

You can still convert the following datas into molecular structure:
(1)SMILES: Ic1occc1
(2)InChI: InChI=1/C4H3IO/c5-4-2-1-3-6-4/h1-3H
(3)InChIKey: ICWZZNUEYMBBRB-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C4H3IO/c5-4-2-1-3-6-4/h1-3H
(5)Std. InChIKey: ICWZZNUEYMBBRB-UHFFFAOYSA-N