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CAS No.: | 2265-93-2 |
---|---|
Name: | 2,4-Difluoroiodobenzene |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C6H3F2I |
Molecular Weight: | 239.991 |
Synonyms: | 1-Iodo-2,4-difluorobenzene;2,4-Difluoro-1-iodobenzene;NSC 68264; |
EINECS: | 218-867-0 |
Density: | 2.001 g/cm3 |
Boiling Point: | 180.6 °C at 760 mmHg |
Flash Point: | 67.8 °C |
Solubility: | insoluble in water |
Appearance: | clear light yellow to slightly brown liquid |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39-37/39 |
PSA: | 0.00000 |
LogP: | 2.56940 |
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The 2,4-Difluoroiodobenzene, with the CAS registry number 2265-93-2, is also known as 1,3-Difluoro-4-iodobenzene. It belongs to the product categories of Aromatic Hydrocarbons (substituted) & Derivatives; Miscellaneous; Fluorine Compounds; Iodine Compounds. This chemical's molecular formula is C6H3F2I and molecular weight is 239.989296. Its IUPAC name is called 2,4-difluoro-1-iodobenzene. What's more, the product should be sealed and stored in cool and dry place.
Physical properties of 2,4-Difluoroiodobenzene: (1)ACD/LogP: 3.23; (2)ACD/LogD (pH 5.5): 3.23; (3)ACD/LogD (pH 7.4): 3.23; (4)ACD/BCF (pH 5.5): 168.68; (5)ACD/BCF (pH 7.4): 168.68; (6)ACD/KOC (pH 5.5): 1366.93; (7)ACD/KOC (pH 7.4): 1366.93; (8)Index of Refraction: 1.566; (9)Molar Refractivity: 39.14 cm3; (10)Molar Volume: 119.9 cm3; (11)Surface Tension: 37.6 dyne/cm; (12)Density: 2.001 g/cm3; (13)Flash Point: 67.8 °C; (14)Enthalpy of Vaporization: 39.98 kJ/mol; (15)Boiling Point: 180.6 °C at 760 mmHg; (16)Vapour Pressure: 1.2 mmHg at 25°C.
Preparation of 2,4-Difluoroiodobenzene: this chemical can be prepared by 2,6-difluoroiodobenzene. This reaction will need reagent LDA and solvents tetrahydrofuran, hexane. The reaction temperature is -75 °C. The yield is about 48%.
Uses of 2,4-Difluoroiodobenzene: it can be used to produce 2,4-difluoro-2'-nitro-1,1'-biphenyl with 1-bromo-2-nitro-benzene at temperature of 120 °C. This reaction will need reagent copper powder with reaction time of 18 hours. The yield is about 47.6%.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1F)F)I
(2)InChI: InChI=1S/C6H3F2I/c7-4-1-2-6(9)5(8)3-4/h1-3H
(3)InChIKey: YKLDMAPEGQYZRT-UHFFFAOYSA-N