101066-87-9
4-IODO-2-(TRIFLUOROMETHYL)BENZONITRILE
CAS: 101066-87-9
Molecular Formula: C8H3F3IN
101066-87-9 - Names and Identifiers
| Name | 4-IODO-2-(TRIFLUOROMETHYL)BENZONITRILE |
| Synonyms | 2-Cyano-5-iodobenzotrifluoride 4-IODO-2-(TRIFLUOROMETHYL)BENZONITRILE 4-Cyano-3-(trifluoromethyl)iodobenzene 4-Iodo-2-(trifluoromethyl)benzonitrile Benzonitrile, 4-iodo-2-(trifluoromethyl)- 2-Cyano-5-iodobenzotrifluoride, 4-Iodo-alpha,alpha,alpha-trifluoro-o-tolunitrile |
| CAS | 101066-87-9 |
| InChI | InChI=1/C8H3F3IN/c9-8(10,11)7-3-6(12)2-1-5(7)4-13/h1-3H |
| InChIKey | RBRTXKYFMXVIER-UHFFFAOYSA-N |
101066-87-9 - Physico-chemical Properties
| Molecular Formula | C8H3F3IN |
| Molar Mass | 297.02 |
| Density | 1.95±0.1 g/cm3(Predicted) |
| Melting Point | 50-55°C |
| Boling Point | 282.3±40.0 °C(Predicted) |
| Flash Point | 110°C |
| Water Solubility | Slightly soluble in water. |
| Solubility | Chloroform, Ethyl Acetate (Slightly) |
| Vapor Presure | 0.00339mmHg at 25°C |
| Appearance | Solid |
| Color | Light Yellow |
| Storage Condition | Keep in dark place,Sealed in dry,Room Temperature |
| Sensitive | Light Sensitive |
| Refractive Index | 1.561 |
| MDL | MFCD08458091 |
101066-87-9 - Risk and Safety
| Hazard Symbols | Xn - Harmful |
| Risk Codes | R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. R36/37/38 - Irritating to eyes, respiratory system and skin. |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36/37 - Wear suitable protective clothing and gloves. |
| UN IDs | UN 3439 6.1/PG 3 |
| WGK Germany | 3 |
| Hazard Class | 6.1 |
| Packing Group | III |
101066-87-9 - Introduction
4-iodo-2-(trifluoromethyl) benzonitrile, chemical formula C7H3F3IN, is an organic compound. The following is a description of its nature, use, preparation and safety information:
Nature:
-Appearance: 4-Iodo-2-(trifluoromethyl) benzonitrile is a colorless crystalline solid.
-Solubility: It is soluble in most organic solvents, such as ethanol, dimethylformamide, etc.
-Melting point: Its melting point is about 80-81°C.
Use:
-4-iodo-2-(trifluoromethyl) benzonitrile can be used in the field of organic synthesis as a raw material or intermediate. It can be used in the synthesis of organic compounds containing iodine and fluorine substituents.
-In addition, it can also be used in the fields of drug synthesis and pesticide research and development.
Preparation Method:
The preparation of 4-iodo-2-(trifluoromethyl) benzonitrile can be obtained by the reaction of iodobenzene and trifluoromethyl bromide. The specific reaction conditions can be optimized according to the experimental requirements.
Safety Information:
-4-iodo-2-(trifluoromethyl) benzonitrile is an organic compound and should be handled with caution and follow relevant laboratory safety procedures.
-It may be irritating to the eyes, skin and respiratory system, so wear appropriate protective equipment such as goggles, gloves and masks during operation.
-In case of accidental contact or inhalation of the compound, rinse immediately with water and seek medical help.
-When storing, it should be stored in a dry, cool place, away from fire and oxidizing agents.
Please note that the above information is for reference only, and relevant safety regulations and operating guidelines should be followed when using and handling the compound.
Nature:
-Appearance: 4-Iodo-2-(trifluoromethyl) benzonitrile is a colorless crystalline solid.
-Solubility: It is soluble in most organic solvents, such as ethanol, dimethylformamide, etc.
-Melting point: Its melting point is about 80-81°C.
Use:
-4-iodo-2-(trifluoromethyl) benzonitrile can be used in the field of organic synthesis as a raw material or intermediate. It can be used in the synthesis of organic compounds containing iodine and fluorine substituents.
-In addition, it can also be used in the fields of drug synthesis and pesticide research and development.
Preparation Method:
The preparation of 4-iodo-2-(trifluoromethyl) benzonitrile can be obtained by the reaction of iodobenzene and trifluoromethyl bromide. The specific reaction conditions can be optimized according to the experimental requirements.
Safety Information:
-4-iodo-2-(trifluoromethyl) benzonitrile is an organic compound and should be handled with caution and follow relevant laboratory safety procedures.
-It may be irritating to the eyes, skin and respiratory system, so wear appropriate protective equipment such as goggles, gloves and masks during operation.
-In case of accidental contact or inhalation of the compound, rinse immediately with water and seek medical help.
-When storing, it should be stored in a dry, cool place, away from fire and oxidizing agents.
Please note that the above information is for reference only, and relevant safety regulations and operating guidelines should be followed when using and handling the compound.
Last Update：2024-04-09 20:49:11
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