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| CAS No.: | 89487-91-2 |
|---|---|
| Name: | 2-IODO-4-NITROPHENOL |
| Article Data: | 39 |
| Molecular Structure: | |
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| Formula: | C6H4INO3 |
| Molecular Weight: | 265.007 |
| Synonyms: | 2-Iodo-4-nitrophenol;4-Hydroxy-3-iodonitrobenzene;NSC 141347; |
| Density: | 2.176 g/cm3 |
| Melting Point: | 89-94°C |
| Boiling Point: | 294.5 °C at 760 mmHg |
| Flash Point: | 131.9 °C |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 22 |
| PSA: | 66.05000 |
| LogP: | 2.42820 |
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- Total:28 Page 1 of 1 1
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Specification
The Phenol, 2-iodo-4-nitro-, with the CAS registry number 89487-91-2, is also known as 2-Iodo-4-nitro-phenol. It belongs to the product category of Aromatic Phenols. This chemical's molecular formula is C6H4INO3 and molecular weight is 265.0053. Its systematic name is called 2-iodo-4-nitrophenol. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties of Phenol, 2-iodo-4-nitro-: (1)ACD/LogP: 2.70; (2)#H bond acceptors: 4; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Index of Refraction: 1.71; (6)Molar Refractivity: 47.58 cm3; (7)Molar Volume: 121.7 cm3; (8)Surface Tension: 70.9 dyne/cm; (9)Density: 2.176 g/cm3; (10)Flash Point: 131.9 °C; (11)Enthalpy of Vaporization: 55.55 kJ/mol; (12)Boiling Point: 294.5 °C at 760 mmHg; (13)Vapour Pressure: 0.000919 mmHg at 25°C.
Preparation: this chemical can be prepared by 4-nitro-phenol. This reaction will need reagent alkali, iodic acid and iodine.
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Uses of Phenol, 2-iodo-4-nitro-: it can be used to produce 5-nitro-2-phenyl-benzofuran at temperature of 20 °C. This reaction will need reagent CuI and solvent acetonitrile, toluene with reaction time of 20 min. The yield is about 66%.
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You can still convert the following datas into molecular structure:
(1)SMILES: Ic1cc([N+]([O-])=O)ccc1O
(2)InChI: InChI=1/C6H4INO3/c7-5-3-4(8(10)11)1-2-6(5)9/h1-3,9H
(3)InChIKey: BKQFOYCEUMVWOW-UHFFFAOYAC