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3-Amino-4-fluorophenol

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3-Amino-4-fluorophenol Basic information

Product Name:
3-Amino-4-fluorophenol
Synonyms:
  • 3-Amino-4-fluorophenol
  • 3-Amino-4-fluorophenol 99%
  • Phenol,3-aMino-4-fluoro-
  • 2-Fluoro-5-hydroxyaniline
  • 6004 3-AMINO-4-FLUORO PHENOL
  • 3-Amino-4-fluorophenol ISO 9001:2015 REACH
CAS:
62257-16-3
MF:
C6H6FNO
MW:
127.12
EINECS:
690-814-8
Product Categories:
  • Phenol&Thiophenol&Mercaptan
Mol File:
62257-16-3.mol
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3-Amino-4-fluorophenol Chemical Properties

Melting point:
141-143 °C
Boiling point:
269.3±20.0 °C(Predicted)
Density 
1.347±0.06 g/cm3(Predicted)
storage temp. 
Keep in dark place,Sealed in dry,Room Temperature
pka
10.03±0.18(Predicted)
form 
crystalline powder
color 
Light tan
InChI
InChI=1S/C6H6FNO/c7-5-2-1-4(9)3-6(5)8/h1-3,9H,8H2
InChIKey
VJCSFNNTQGRAKH-UHFFFAOYSA-N
SMILES
C1(O)=CC=C(F)C(N)=C1
CAS DataBase Reference
62257-16-3(CAS DataBase Reference)
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Safety Information

Hazard Codes 
Xn
Risk Statements 
22
Hazard Note 
Toxic
HS Code 
2922290090
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3-Amino-4-fluorophenol Usage And Synthesis

Description

3-amino-4-fluorophenol is a kind of organic chemistry intermediate commonly used as the intermediate for synthesizing compounds of liquid crystals, pharmaceutical compounds and agricultural chemical compounds used always.

Uses

3-Amino-4-fluorophenol is used to produce drugs with specific biological activities, including antibiotics and anti-inflammatory agents.

Synthesis

Add 450ml water in the 5L reaction flask, 708.5g (10.9mol) zinc powder, 303g (1.09mol) 2-bromo-4-fluoro-5-amino-benzene oxygen ethyl formate, mix, 45 ℃ drip the solution that 218g (5.45mol) sodium hydroxide and 1500ml water are made into down, insulated and stirred is warming up to 60 ℃ after 1 hour to be incubated 4 hours after reactions more complete, the cooling suction filtration, getting filtrate dropping 406g (3.33mol) 30% hydrochloric acid separates product, filtration obtains brown solid, use ethyl alcohol recrystallization, get yellow solid 118.5g (0.93mol) 3-amino-4-fluorophenol after the drying. A molar yield of 85% is 99.5% through gas chromatography determination purity.136 ℃/20mmHg of boiling point.

References

[1] Organic Process Research and Development, 2014, vol. 18, # 1, p. 122 - 134
[2] Patent: US2008/90856, 2008, A1. Location in patent: Page/Page column 38
[3] Patent: WO2010/51373, 2010, A1. Location in patent: Page/Page column 75-76
[4] Patent: WO2013/36232, 2013, A2. Location in patent: Paragraph 00253
[5] Patent: US2009/137595, 2009, A1

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