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CAS No.: | 403-80-5 |
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Name: | 3,5-difluoro-N-(4-fluorophenyl)aniline |
Molecular Structure: | |
Formula: | C12H8F3N |
Molecular Weight: | 223.19 |
Synonyms: | NSC 51795;3,5-Difluoro-N-(4-fluorophenyl)aniline; |
Density: | 1.327 g/cm3 |
Boiling Point: | 263.4 °C at 760 mmHg |
Flash Point: | 113.1 °C |
PSA: | 12.03000 |
LogP: | 3.92050 |
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The Benzenamine,3,5-difluoro-N-(4-fluorophenyl)- has the CAS registry number 403-80-5. This chemical's molecular formula is C12H8F3N and molecular weight is 223.19. What's more, its systematic name is 3,5-difluoro-N-(4-fluorophenyl)aniline.
Physical properties of Benzenamine,3,5-difluoro-N-(4-fluorophenyl)- are: (1)ACD/LogP: 4.43; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 3.24 Å2; (7)Index of Refraction: 1.575; (8)Molar Refractivity: 55.6 cm3; (9)Molar Volume: 168.1 cm3; (10)Polarizability: 22.04×10-24cm3; (11)Surface Tension: 39.7 dyne/cm; (12)Density: 1.327 g/cm3; (13)Flash Point: 113.1 °C; (14)Enthalpy of Vaporization: 50.12 kJ/mol; (15)Boiling Point: 263.4 °C at 760 mmHg; (16)Vapour Pressure: 0.0103 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(cc1)Nc2cc(F)cc(F)c2
(2)InChI: InChI=1S/C12H8F3N/c13-8-1-3-11(4-2-8)16-12-6-9(14)5-10(15)7-12/h1-7,16H
(3)InChIKey: GSHQTKAPMXVMJR-UHFFFAOYSA-N