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| CAS No.: | 2729-34-2 |
|---|---|
| Name: | 3,5-dichloro-4-fluoroaniline |
| Molecular Structure: | |
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| Formula: | C6H4Cl2FN |
| Molecular Weight: | 180.009 |
| Synonyms: | Aniline,3,5-dichloro-4-fluoro- (6CI,8CI);3,5-Dichloro-4-fluoro-phenylamine; |
| EINECS: | 220-345-2 |
| Density: | 1.502 g/cm3 |
| Melting Point: | 100-101°C |
| Boiling Point: | 287.172 °C at 760 mmHg |
| Flash Point: | 127.477 °C |
| PSA: | 26.02000 |
| LogP: | 3.29590 |
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| Conditions | Yield |
|---|---|
| With hydrogen In methanol Inert atmosphere; | 90% |
| With hydrogenchloride; tin(ll) chloride | |
| With ammonium formate; zinc In methanol; water for 1.33333h; |
- 20098-48-0
3,4,5-trichloronitrobenzen
- 2729-34-2
3,5-dichloro-4-fluorophenylamine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: dimethylformamide; potassium fluoride / 150 °C 2: SnCl2; aqueous HCl View Scheme | |
| Multi-step reaction with 2 steps 1: potassium fluoride; N-benzyl-N,N,N-triethylammonium chloride / 11 h / 140 - 175 °C 2: hydrogen / methanol / Inert atmosphere View Scheme |
| Conditions | Yield |
|---|---|
| Stage #1: 3,5-dichloro-4-fluorophenylamine With nitrosylsulfuric acid at 10 - 15℃; for 6h; Stage #2: With copper(I) oxide; sodium hypophosphite; sulfuric acid; water for 1h; | 86% |
| Conditions | Yield |
|---|---|
| With hydrogenchloride In ethanol; water at 140℃; for 1.5h; Microwave irradiation; Sealed tube; | 81% |
- 2729-34-2
3,5-dichloro-4-fluorophenylamine
| Conditions | Yield |
|---|---|
| With pyridine In dichloromethane at 20℃; for 12h; Inert atmosphere; | 76% |
- 2729-34-2
3,5-dichloro-4-fluorophenylamine
| Conditions | Yield |
|---|---|
| With pyridine In dichloromethane at 20℃; for 12h; Inert atmosphere; | 64% |
| Conditions | Yield |
|---|---|
| Stage #1: 3,5-dichloro-4-fluorophenylamine With hydrogenchloride; sodium nitrite In water at -5℃; Stage #2: potassium ethyl xanthogenate In water at 50℃; for 3h; | 60% |
| With hydrogenchloride; sodium nitrite In water at 0 - 70℃; for 2h; |
| Conditions | Yield |
|---|---|
| With pyridine In tetrahydrofuran at 0 - 20℃; for 16h; Inert atmosphere; | 55% |
| With sodium hydrogencarbonate In water; ethyl acetate |
- 2729-34-2
3,5-dichloro-4-fluorophenylamine
| Conditions | Yield |
|---|---|
| With tris-(dibenzylideneacetone)dipalladium(0); sodium t-butanolate; tert-butyl XPhos In toluene at 20 - 85℃; for 15.0833h; Inert atmosphere; | 53% |
- 2729-34-2
3,5-dichloro-4-fluorophenylamine
| Conditions | Yield |
|---|---|
| With tris-(dibenzylideneacetone)dipalladium(0); sodium t-butanolate; tert-butyl XPhos In toluene at 110℃; for 18h; Inert atmosphere; | 15% |
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Chemistry
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IUPAC Name: 3,5-Dichloro-4-fluoroaniline
Molecular Formula: C6H4Cl2FN
Molecular Weight: 180.01 g/mol
Canonical SMILES: c1(c(cc(cc1Cl)N)Cl)F
InChI: InChI=1/C6H4Cl2FN/c7-4-1-3(10)2-5(8)6(4)9/h1-2H,10H2
EINECS: 220-345-2
Product Categories: Chiral chemicals
Index of Refraction: 1.587
Molar Refractivity: 40.27 cm3
Molar Volume: 119.8 cm3
Polarizability: 15.96×10-24 cm3
Surface Tension: 45.9 dyne/cm
Density: 1.502 g/cm3
Flash Point: 127.5 °C
Enthalpy of Vaporization: 52.63 kJ/mol
Boiling Point: 287.2 °C at 760 mmHg
Melting Point: 100-101 °C
Vapour Pressure of 3,5-Dichloro-4-fluoroaniline (CAS NO.2729-34-2): 0.00252 mmHg at 25 °C
Specification
3,5-Dichloro-4-fluoroaniline (CAS NO.2729-34-2), its Synonyms are 3,5-Dichloro-4-fluorobenzenamine ; 3,5-Dichloro-4-fluoro-phenylamine ; Benzenamine, 3,5-dichloro-4-fluoro- .