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
  • 6-chloro-1-methyl-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
  • 3-iodo-1H-pyrrolo[2,3-b]pyridine-6-carboxylic acid
  • methyl2-methyl-1H-pyrrolo[2,3-b]pyridine-6-carboxylate
  • {2-methyl-1H-pyrrolo[2,3-b]pyridin-6-yl}methanamine
  • 3-iodo-1H-pyrrolo[2,3-b]pyridin-6-amine
  • (9H-fluoren-9-yl)methyl N-(4-hydroxy-2-methylpentyl)carbamate
  • (S)-1-(2-Methyl-5-(trifluoromethyl)phenyl)ethan-1-amine
  • 5-[(4-Ethenylbenzyl)oxy]-2-[4-(2-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]phenol
  • 2-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylicacid
  • methyl2-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate
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