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CAS No.: | 651-83-2 |
---|---|
Name: | 2,3,5,6-TETRAFLUORO-4-AMINOBENZOTRIFLUORIDE |
Article Data: | 17 |
Molecular Structure: | |
Formula: | C7H2F7N |
Molecular Weight: | 233.088 |
Synonyms: | 4-Aminotetrafluorobenzotrifluoride;2,3,5,6-Tetrafluoro-4-aminobenzotrifluoride;4-Amino-2,3,5,6-tetrafluorobenzotrifluoride; |
Density: | 1.64 g/cm3 |
Boiling Point: | 171.7 °C at 760 mmHg |
Flash Point: | 67.9 °C |
Appearance: | Clear colourless to light brown liquid |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 26.02000 |
LogP: | 3.42520 |
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The CAS register number of 2,3,5,6-Ttrafluoro-4-(trifluoromethyl)aniline is 651-83-2. It also can be called as 4-Amino-2,3,5,6-tetrafluorobenzotrifluoride. The molecular formula about this chemical is C7H2F7N and the molecular weight is 233.09.
Physical properties about 2,3,5,6-Ttrafluoro-4-(trifluoromethyl)aniline are: (1)ACD/LogP: 3.28; (2)ACD/LogD (pH 5.5): 3.28; (3)ACD/LogD (pH 7.4): 3.28; (4)ACD/BCF (pH 5.5): 183.59; (5)ACD/BCF (pH 7.4): 183.59; (6)ACD/KOC (pH 5.5): 1452.34; (7)ACD/KOC (pH 7.4): 1452.34; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 3.24 Å2; (12)Index of Refraction: 1.413; (13)Molar Refractivity: 35.44 cm3; (14)Molar Volume: 142 cm3; (15)Polarizability: 14.05x10-24cm3; (16)Surface Tension: 25.3 dyne/cm; (17)Density: 1.64 g/cm3; (18)Flash Point: 67.9 °C; (19)Enthalpy of Vaporization: 40.81 kJ/mol; (20)Boiling Point: 171.7 °C at 760 mmHg; (21)Vapour Pressure: 1.38 mmHg at 25 °C.
Uses of 2,3,5,6-Ttrafluoro-4-(trifluoromethyl)aniline: it can be used to produce N-(p-trifluoromethyl-tetrafluorophenyl)-p-amino-tetrafluorobenzimidoyl chloride with tetrachloromethane. This reaction will need reagent of AlCl3. The reaction time is 14 hours with ambient temperature. The yield is about 30%.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. If you want to use this chemical, wear suitable protective clothing. In case of 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: Fc1c(c(F)c(F)c(N)c1F)C(F)(F)F
(2)InChI: InChI=1/C7H2F7N/c8-2-1(7(12,13)14)3(9)5(11)6(15)4(2)10/h15H2
(3)InChIKey: FJOACTZFMHZHSC-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C7H2F7N/c8-2-1(7(12,13)14)3(9)5(11)6(15)4(2)10/h15H2
(5)Std. InChIKey: FJOACTZFMHZHSC-UHFFFAOYSA-N