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| CAS No.: | 348-64-1 |
|---|---|
| Name: | 2,4-DICHLORO-5-FLUOROANILINE |
| Molecular Structure: | |
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| Formula: | C6H4Cl2FN |
| Molecular Weight: | 180.009 |
| Synonyms: | Aniline,2,4-dichloro-5-fluoro- (6CI,8CI);2,4-Dichloro-5-fluoroaniline;2,4-Dichloro-5-fluoro aniline;2,4-Dichloro-5-fluoro-benzenamine; |
| Density: | 1.502 g/cm3 |
| Melting Point: | 62-65 °C |
| Boiling Point: | 250.4 °C at 760 mmHg |
| Flash Point: | 105.3 °C |
| Hazard Symbols: | T |
| Risk Codes: | 25 |
| Safety: | 45 |
| PSA: | 26.02000 |
| LogP: | 3.29590 |
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Specification
The 2,4-Dichloro-5-fluoro aniline, with the CAS registry number 348-64-1, is also known as 2,4-Dichloro-5-fluoro-benzenamine. This chemical's molecular formula is C6H4Cl2FN and molecular weight is 180.01. What's more, its systematic name is 2,4-dichloro-5-fluoroaniline.
Physical properties of 2,4-Dichloro-5-fluoro aniline are: (1)ACD/LogP: 3.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.25; (4)ACD/BCF (pH 5.5): 173.94; (5)ACD/BCF (pH 7.4): 173.95; (6)ACD/KOC (pH 5.5): 1397.3; (7)ACD/KOC (pH 7.4): 1397.34; (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: 1.587; (13)Molar Refractivity: 40.27 cm3; (14)Molar Volume: 119.8 cm3; (15)Surface Tension: 45.9 dyne/cm; (16)Density: 1.502 g/cm3; (17)Flash Point: 105.3 °C; (18)Enthalpy of Vaporization: 48.77 kJ/mol; (19)Boiling Point: 250.4 °C at 760 mmHg; (20)Vapour Pressure: 0.0217 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(Cl)cc(Cl)c(N)c1
(2)InChI: InChI=1S/C6H4Cl2FN/c7-3-1-4(8)6(10)2-5(3)9/h1-2H,10H2
(3)InChIKey: DKMSPQQQAXTFLP-UHFFFAOYSA-N