2-METHYL-3-(TRIFLUOROMETHYL)ANILINE
2-Methyl-3-trifluoromethylaniline
CAS: 54396-44-0
Molecular Formula: C8H8F3N
2-METHYL-3-(TRIFLUOROMETHYL)ANILINE - Names and Identifiers
| Name | 2-Methyl-3-trifluoromethylaniline |
| Synonyms | MABTF 3-TRIFLUOROMETHYL-O-TOLUIDINE 2-Methyl-3-Trifluoromethylanil 3-AMINO-2-METHYLBENZOTRIFLUORIDE 2-methyl-3-thifluoromethylaniline 2-Methyl-3-trifluoromethylaniline 3-PERFLUOROMETHYL-2-METHYLANILINE 2-Methyl-3-Amino Benzotrifluoride 2-Amino-6-trifluoromethyl toluene 2-METHYL-3-(TRIFLUOROMETHYL)ANILINE 2-methyl-3-trifluoromethylaniline(MTA) 2-METHYL-3-TRIFLUOROMETHYL-PHENYLAMINE 2-Methyl-3-(trifluoromethyl)benzenamine 2-methyl-3-trifluoromethylaniline (intermediate of flunixin) [2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluoro-10-(2-propylpentanoyloxy)decyl] 2-propylpentanoate |
| CAS | 54396-44-0 |
| EINECS | 259-145-5 |
| InChI | InChI=1/C26H34F16O4/c1-5-9-15(10-6-2)17(43)45-13-19(27,28)21(31,32)23(35,36)25(39,40)26(41,42)24(37,38)22(33,34)20(29,30)14-46-18(44)16(11-7-3)12-8-4/h15-16H,5-14H2,1-4H3 |
2-METHYL-3-(TRIFLUOROMETHYL)ANILINE - Physico-chemical Properties
| Molecular Formula | C8H8F3N | |||
| Molar Mass | 175.15 | |||
| Density | 1.237±0.06 g/cm3(Predicted) | |||
| Melting Point | 38-42°C(lit.) | |||
| Boling Point | 62-64°C 4mm | |||
| Flash Point | >210°F | |||
| Solubility | Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) | |||
| Vapor Presure | 1.29E-08mmHg at 25°C | |||
| Appearance | Crystalline Powder | |||
| Color | White | |||
| BRN | 2832865 | |||
| pKa | 3.23±0.10(Predicted) | |||
| Storage Condition | Keep in dark place,Inert atmosphere,Room temperature | |||
| Refractive Index | 1.38 | |||
| MDL | MFCD00153216 | |||
| Physical and Chemical Properties |
|
2-METHYL-3-(TRIFLUOROMETHYL)ANILINE - Risk and Safety
| Risk Codes | R36/37/38 - Irritating to eyes, respiratory system and skin. R26/27/28 - Very toxic by inhalation, in contact with skin and if swallowed. |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36 - Wear suitable protective clothing. S24/25 - Avoid contact with skin and eyes. |
| UN IDs | 2811 |
| WGK Germany | 3 |
| HS Code | 29214990 |
| Hazard Note | Toxic |
| Hazard Class | 6.1 |
2-METHYL-3-(TRIFLUOROMETHYL)ANILINE - Introduction
It is an organic compound. Its molecular formula is C8H8F3N and its molecular weight is 167.15.
The properties of the compound are as follows:
-Appearance: Colorless to light yellow solid
-Melting point: 36-40 degrees Celsius
-Boiling point: 197 degrees Celsius
-Density: 1.29g/cm³
-Solubility: Slightly soluble in water, soluble in organic solvents such as ethanol, ether and benzene
It is an important organic synthesis intermediate, and its use mainly includes the following aspects:
-as a drug synthesis intermediates, involved in the synthesis of anti-cancer drugs, antiviral drugs and pesticides.
-Used as a light-emitting material in organic light-emitting diodes (OLEDs).
-Used as probe molecules in chemical research.
The preparation method can be carried out by the following steps:
1. Aniline (aniline) reacts with trifluoroformic acid (trifluoroacetic acid) to generate methyl trifluoroformate.
2. Heat the trifluoroformate to obtain the target product.
When using and storing the following safety information:
-Wear appropriate personal protective equipment such as lab coats, glasses and gloves.
-Avoid breathing its vapors or dust.
-Avoid contact with skin, eyes and clothing.
-During use, ensure that the operating area is well ventilated.
-Store it in a cool, dry place, away from combustibles and oxidants.
-In case of skin and eye contact, rinse immediately with water and seek medical help.
The properties of the compound are as follows:
-Appearance: Colorless to light yellow solid
-Melting point: 36-40 degrees Celsius
-Boiling point: 197 degrees Celsius
-Density: 1.29g/cm³
-Solubility: Slightly soluble in water, soluble in organic solvents such as ethanol, ether and benzene
It is an important organic synthesis intermediate, and its use mainly includes the following aspects:
-as a drug synthesis intermediates, involved in the synthesis of anti-cancer drugs, antiviral drugs and pesticides.
-Used as a light-emitting material in organic light-emitting diodes (OLEDs).
-Used as probe molecules in chemical research.
The preparation method can be carried out by the following steps:
1. Aniline (aniline) reacts with trifluoroformic acid (trifluoroacetic acid) to generate methyl trifluoroformate.
2. Heat the trifluoroformate to obtain the target product.
When using and storing the following safety information:
-Wear appropriate personal protective equipment such as lab coats, glasses and gloves.
-Avoid breathing its vapors or dust.
-Avoid contact with skin, eyes and clothing.
-During use, ensure that the operating area is well ventilated.
-Store it in a cool, dry place, away from combustibles and oxidants.
-In case of skin and eye contact, rinse immediately with water and seek medical help.
Last Update：2024-04-10 22:40:09
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