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459-19-8

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Basic Information
CAS No.: 459-19-8
Name: 4-FLUOROPHENETHYLAMINE HYDROCHLORIDE
Article Data: 6
Molecular Structure:
Molecular Structure of 459-19-8 (4-FLUOROPHENETHYLAMINE HYDROCHLORIDE)
Formula: C8H10 F N . Cl H
Molecular Weight: 175.633
Synonyms: Benzeneethanamine,4-fluoro-, hydrochloride (9CI); Phenethylamine, p-fluoro-, hydrochloride(6CI,8CI); 2-(4-Fluorophenyl)ethylamine hydrochloride; 4-Fluorophenethylaminehydrochloride; p-Fluorophenethylamine hydrochloride
Density: 1.069g/cm3
Melting Point: 200-206 °C(lit.)
Boiling Point: 251.7°Cat760mmHg
Flash Point: 85.6°C
Solubility: Soluble in water
Hazard Symbols:
Risk Codes: 20/21/22
Safety:
Hazard Codes Xn
Risk Statements 20/21/22
Safety Statements 36
RIDADR 2811
RTECS SH6978000
HazardClass 6.1(b)
PackingGroup III
PSA: 26.02000
LogP: 2.82920
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Synthetic route
459-22-3

4-fluorophenylacetonitrile

459-19-8

2-(4-fluorophenyl)ethylamine hydrochloride

Conditions
ConditionsYield
With hydrogenchloride; hydrogen In propan-1-ol; water at 60℃; under 375.038 Torr; for 18h; Flow reactor;100%
Stage #1: 4-fluorophenylacetonitrile With borane-ammonia complex; C17H16BrMnN2O3S In hexane at 60℃; for 6h;
Stage #2: With hydrogenchloride In diethyl ether; water		81%
Multi-step reaction with 3 steps
1: C16H11BrMnN3O3 / tetrahydrofuran / 24 h / 120 °C / Inert atmosphere; Sealed tube
2: sodium hydroxide; water / tetrahydrofuran; methanol / 20 °C
3: hydrogenchloride / water / 20 °C
View Scheme
332-43-4

1-(2-chloroethyl)-4-fluorobenzene

A

Bis-[2-(4-fluoro-phenyl)-ethyl]-amine

B

459-19-8

2-(4-fluorophenyl)ethylamine hydrochloride

Conditions
ConditionsYield
With ammonia In methanol at 130℃; for 2.5h; microwave irradiation;

(E)-1-tert-butyl-N-(4-fluorostyryl)-1,1-dimethylsilanamine

A

459-19-8

2-(4-fluorophenyl)ethylamine hydrochloride

B

Bis-[2-(4-fluoro-phenyl)-ethyl]-amine; hydrochloride

Conditions
ConditionsYield
Stage #1: (E)-1-tert-butyl-N-(4-fluorostyryl)-1,1-dimethylsilanamine With 2.5% wt Pd/C; hydrogen In benzene-d6 at 20℃; under 760.051 Torr; for 40h;
Stage #2: With hydrogenchloride In diethyl ether; benzene-d6; ethyl acetate

C20H22FNSi2

459-19-8

2-(4-fluorophenyl)ethylamine hydrochloride

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: sodium hydroxide; water / tetrahydrofuran; methanol / 20 °C
2: hydrogenchloride / water / 20 °C
View Scheme
1583-88-6

4-fluoro-2-phenethylamine

459-19-8

2-(4-fluorophenyl)ethylamine hydrochloride

Conditions
ConditionsYield
With hydrogenchloride In water at 20℃;

(3R,4R)-1-(tert-butoxycarbonyl)pyrrolidine-3,4-dicarboxylic acid

459-19-8

2-(4-fluorophenyl)ethylamine hydrochloride

tert-butyl (3R,4R)-3,4-bis((4-fluorophenethyl)carbamoyl)pyrrolidine-1-carboxylate

Conditions
ConditionsYield
With 2,6-dimethylpyridine; 1-hydroxy-7-aza-benzotriazole; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In N,N-dimethyl-formamide at 23℃; for 18h;93%
With 2,6-dimethylpyridine; 1-hydroxy-7-aza-benzotriazole; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In N,N-dimethyl-formamide at 23℃; for 18h; Inert atmosphere;93%
459-19-8

2-(4-fluorophenyl)ethylamine hydrochloride

(3S,4S)-1-(tert-butoxycarbonyl)pyrrolidine-3,4-dicarboxylic acid

tert-butyl (3S,4S)-3,4-bis((4-fluorophenethyl)carbamoyl)pyrrolidine-1-carboxylate

Conditions
ConditionsYield
With 2,6-dimethylpyridine; 1-hydroxy-7-aza-benzotriazole; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In N,N-dimethyl-formamide at 23℃; for 24h;93%
With 2,6-dimethylpyridine; 1-hydroxy-7-aza-benzotriazole; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In N,N-dimethyl-formamide at 23℃; for 24h; Inert atmosphere;93%

trans-1-(tert-butoxycarbonyl)-4-(methoxycarbonyl)pyrrolidine-3-carboxylic acid

459-19-8

2-(4-fluorophenyl)ethylamine hydrochloride

1-(tert-butyl) 3-methyl trans-4-((4-fluorophenethyl)carbamoyl)pyrrolidine-1,3-dicarboxylate

Conditions
ConditionsYield
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 23℃; for 48h;41%

trans-1-(tert-butoxycarbonyl)-4-(methoxycarbonyl)pyrrolidine-3-carboxylic acid

459-19-8

2-(4-fluorophenyl)ethylamine hydrochloride

1-(tert-butyl) 3-methyl trans-4-((4-fluorophenethyl)carbamoyl)pyrrolidine-1,3-dicarboxylate

Conditions
ConditionsYield
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 23℃; for 48h;41%
120-57-0

piperonal

459-19-8

2-(4-fluorophenyl)ethylamine hydrochloride

N-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)ethanamine

Conditions
ConditionsYield
Stage #1: piperonal; 2-(4-fluorophenyl)ethylamine hydrochloride With triethylamine In dichloromethane at 25℃; Molecular sieve;
Stage #2: With sodium tris(acetoxy)borohydride In dichloromethane at 25℃;		37%
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