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3831-49-0

Basic Information
CAS No.: 3831-49-0
Name: 1,2,2,2-TETRAFLUOROETHYL IODIDE
Article Data: 7
Molecular Structure:
Molecular Structure of 3831-49-0 (1,2,2,2-TETRAFLUOROETHYL IODIDE)
Formula: C2HF4I
Molecular Weight: 227.928
Synonyms: 1,1,1,2-Tetrafluoro-2-iodoethane;1,1,1,2-Tetrafluoroiodoethane;1,2,2,2-Tetrafluoro-1-iodoethane;
Density: 2.221 g/cm3
Boiling Point: 38.8 °C at 760 mmHg
Flash Point: 1.2 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 0.00000
LogP: 2.27930
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    1,2,2,2-TETRAFLUOROETHYL IODIDE

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    3831-49-0

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Specification

The Ethane,1,1,1,2-tetrafluoro-2-iodo- is an organic compound with the formula C2HF4I. The systematic name of this chemical is 1,1,1,2-tetrafluoro-2-iodoethane. With the CAS registry number 3831-49-0, it is also named as 1,2,2,2-Tetrafluoroethyl iodide. Besides, it should be stored in a dark dry and well-ventilated place.

Physical properties about Ethane,1,1,1,2-tetrafluoro-2-iodo- are: (1)ACD/LogP: 2.31; (2)ACD/LogD (pH 5.5): 2.31; (3)ACD/LogD (pH 7.4): 2.31; (4)ACD/BCF (pH 5.5): 33.37; (5)ACD/BCF (pH 7.4): 33.37; (6)ACD/KOC (pH 5.5): 428.58; (7)ACD/KOC (pH 7.4): 428.58; (8)Index of Refraction: 1.399; (9)Molar Refractivity: 24.86 cm3; (10)Molar Volume: 102.5 cm3; (11)Polarizability: 9.85×10-24cm3; (12)Surface Tension: 19.7 dyne/cm; (13)Density: 2.221 g/cm3; (14)Flash Point: 1.2 °C; (15)Enthalpy of Vaporization: 27.17 kJ/mol; (16)Boiling Point: 38.8 °C at 760 mmHg; (17)Vapour Pressure: 461 mmHg at 25°C.

Preparation: this chemical can be prepared by trifluoroethene. This reaction will need reagent ICl, HF, BF3. The reaction time is 16 hours with reaction temperature of 25 °C. The yield is about 73%.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)C(F)I
(2)InChI: InChI=1/C2HF4I/c3-1(7)2(4,5)6/h1H
(3)InChIKey: JDAWHMRSFSKYTB-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C2HF4I/c3-1(7)2(4,5)6/h1H
(5)Std. InChIKey: JDAWHMRSFSKYTB-UHFFFAOYSA-N