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CAS No.: | 203059-85-2 |
---|---|
Name: | 1,2-Diiodo-4-fluorobenzene |
Article Data: | 1 |
Molecular Structure: | |
Formula: | C6H3FI2 |
Molecular Weight: | 347.897 |
Synonyms: | 4-Fluoro-1,2-diiodobenzene; |
Density: | 2.524 g/cm3 |
Boiling Point: | 272.7 °C at 760 mmHg |
Flash Point: | 109.9 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 0.00000 |
LogP: | 3.03490 |
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The 1,2-Diiodo-4-fluorobenzene, with CAS registry number 203059-85-2, belongs to the following product categories: (1)Fluorine Compounds; (2)Iodine Compounds. It has the systematic name of 4-fluoro-1,2-diiodobenzene. Besides this, it is also called 3,4-Diiodofluorobenzene. And the chemical formula of this chemical is C6H3FI2.
Physical properties of 1,2-Diiodo-4-fluorobenzene: (1)ACD/LogP: 4.18; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.18; (4)ACD/LogD (pH 7.4): 4.18; (5)ACD/BCF (pH 5.5): 886.89; (6)ACD/BCF (pH 7.4): 886.89; (7)ACD/KOC (pH 5.5): 4484.21; (8)ACD/KOC (pH 7.4): 4484.21; (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: 1.679; (14)Molar Refractivity: 52.06 cm3; (15)Molar Volume: 137.7 cm3; (16)Polarizability: 20.63×10-24cm3; (17)Surface Tension: 49.5 dyne/cm; (18)Density: 2.524 g/cm3; (19)Flash Point: 104.4 °C; (20)Enthalpy of Vaporization: 47.76 kJ/mol; (21)Boiling Point: 260 °C at 760 mmHg; (22)Vapour Pressure: 0.0203 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The 1,2-Diiodo-4-fluorobenzene irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If 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: Fc1cc(I)c(I)cc1
(2)InChI: InChI=1/C6H3FI2/c7-4-1-2-5(8)6(9)3-4/h1-3H
(3)InChIKey: YWDQZXYXZFFYJQ-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C6H3FI2/c7-4-1-2-5(8)6(9)3-4/h1-3H
(5)Std. InChIKey: YWDQZXYXZFFYJQ-UHFFFAOYSA-N