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CAS No.: | 175277-91-5 |
---|---|
Name: | 3-AMINO-4-(ISOPROPYLAMINO)BENZOTRIFLUORIDE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C10H13F3N2 |
Molecular Weight: | 218.222 |
Synonyms: | 3-Amino-4-(isopropylamino)benzotrifluoride; |
Density: | 1.225 g/cm3 |
Melting Point: | 63-65 °C |
Boiling Point: | 276.6 °C at 760 mmHg |
Flash Point: | 121.1 °C |
Hazard Symbols: | Xi |
Risk Codes: | 20/21/22-36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 38.05000 |
LogP: | 3.76210 |
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The 1,2-Benzenediamine,N1-(1-methylethyl)-4-(trifluoromethyl)-, with the CAS registry number 175277-91-5, is also known as 3-Amino-4-(isopropylamino)benzotrifluoride. This chemical's molecular formula is C10H13F3N2 and molecular weight is 218.22. What's more, its systematic name is N-[2-amino-4-(trifluoromethyl)phenyl]-N-isopropylamine.
Physical properties about 1,2-Benzenediamine,N1-(1-methylethyl)-4-(trifluoromethyl)- are: (1)ACD/LogP: 3.41; (2)H bond acceptors: 2; (3)H bond donors: 3; (4)Freely Rotating Bonds: 3; (5)Polar Surface Area: 6.48 Å2; (6)Index of Refraction: 1.521; (7)Molar Refractivity: 54.3 cm3; (8)Molar Volume: 178 cm3; (9)Polarizability: 21.52×10-24 cm3; (10)Surface Tension: 32.8 dyne/cm; (11)Density: 1.225 g/cm3; (12)Flash Point: 121.1 °C ; (13)Enthalpy of Vaporization: 51.51 kJ/mol; (14)Boiling Point: 276.6 °C at 760 mmHg; (15)Vapour Pressure: 0.00476 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES:FC(F)(F)c1ccc(NC(C)C)c(c1)NCopyCopied ;
(2)InChI:InChI=1/C10H13F3N2/c1-6(2)15-9-4-3-7(5-8(9)14)10(11,12)13/h3-6,15H,14H2,1-2H3 CopyCopied ;
(3)InChIKey:ZNVHJHXDEMIHDL-UHFFFAOYAC.