UNII:2FZ7LD4B44

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Names

[ CAS No. ]:
488787-59-3

[ Name ]:
UNII:2FZ7LD4B44

[Synonym ]:
Benzonitrile, 4-[(1S)-4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)-
UNII:2FZ7LD4B44
Q1R CCN FXQR DF&3N1&1
4-[(1S)-4-(Dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile
4-[4-(Dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile
Benzonitrile, 4-[4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)-
Q1R CCN FXQR DF&3N1&1 &&S Form
(RS)-4-(4-Dimethylamino-1-(4-fluorophenyl)-1-hydroxybutyl)-3-(hydroxymethyl)benzonitrile

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
537.2±50.0 °C at 760 mmHg

[ Molecular Formula ]:
C20H23FN2O2

[ Molecular Weight ]:
342.407

[ Flash Point ]:
278.7±30.1 °C

[ Exact Mass ]:
342.174347

[ PSA ]:
67.49000

[ LogP ]:
2.22

[ Vapour Pressure ]:
0.0±1.5 mmHg at 25°C

[ Index of Refraction ]:
1.598

Safety Information

[ HS Code ]:
2926909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • UNII:2FZ7LD4B44
  • (+/-)-3-(acetoxymethyl)-4-[4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]benzonitrile
  • (S)-(-)-3-(acetoxymethyl)-4-[4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]benzonitrile
  • 4-(4-Fluorobenzoyl)-3-(hydroxymethyl)benzonitrile
  • magnesium,N,N-dimethylpropan-1-amine,chloride

DownStream

  • Citalopram
  • Escitalopram
  • Escitalopram oxalate

Customs

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • UNII:2FZ7LD4B44
  • N,N-Dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)pyridin-4-amine
  • 4-(Pyrrolidin-1-YL)pyridine-3-boronic acid pinacol ester
  • 4-Morpholinopyridine-3-boronic acid pinacol ester
  • N-Cyclopropyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)pyridin-4-amine
  • 3-Ethoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)pyridine
  • 2-(Acetoxy)pyridine-3-boronic acid pinacol ester
  • 2-Carbamoylpyridine-3-boronic acid pinacol ester
  • 2-(Methylcarbamoyl)pyridine-3-boronic acid pinacol ester
  • N,N-Dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)picolinamide
  • N-Cyclopentyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)pyridin-2-amine
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