IODOTRIFLUOROETHYLENE

The Ethene, 1, 1, 2-trifluoro-2-iodo-, with the CAS registry number 359-37-5, is also known as Iodotrifluoroethene. Its EINECS registry number is 206-629-9. This chemical's molecular formula is C₂F₃I and molecular weight is 207.92. What's more, its IUPAC name is 1, 1, 2-Trifluoro-2-iodoethene. Besides, this chemical must be kept in cold storage.

Physical properties about Ethene, 1, 1, 2-trifluoro-2-iodo- are: (1)ACD/LogP: 2.82; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.82; (4)ACD/LogD (pH 7.4): 2.82; (5)ACD/BCF (pH 5.5): 81.79; (6)ACD/BCF (pH 7.4): 81.79; (7)ACD/KOC (pH 5.5): 814.2; (8)ACD/KOC (pH 7.4): 814.2; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.457; (14)Molar Refractivity: 24.51 cm³; (15)Molar Volume: 89.9 cm³; (16)Polarizability: 9.71×10^-24 cm³; (17)Surface Tension: 21.5 dyne/cm; (18)Density: 2.311 g/cm³; (19)Enthalpy of Vaporization: 26.42 kJ/mol; (20)Boiling Point: 30 °C at 760 mmHg; (21)Vapour Pressure: 636 mmHg at 25 °C.

Preparation of Ethene, 1, 1, 2-trifluoro-2-iodo-: this chemical is prepared by 1, 1, 1, 2-Tetrafluoro-ethane. The reaction needs reagents BuLi and I₂. Meanwhile, it needs solvents Hexane and Diethyl ether. The reaction temperature is -78 °C. The yield is about 59 %.

Uses of Ethene, 1, 1, 2-trifluoro-2-iodo-: it is used to produce other chemicals. For example, it is used to produce 1, 1, 2-Trifluoro-1-hepten-3-yne at ambient temperature. The reaction needs reagent Et₃N and solvent Acetonitrile. Meanwhile, it needs catalysts Pd(PPh₃)₂Cl₂ and CuI. The reaction time is 3 days. The yield is about 51 %.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable protective clothing, gloves and eye/face protection. 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: F/C(F)=C(\F)I
(2) InChI: InChI=1/C2F3I/c3-1(4)2(5)6
(3) InChIKey: PZVZTKFRZJMHEM-UHFFFAOYAB