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Home > Encyclopedia > 2-Amino-5-fluorobenzonitrile

2-Amino-5-fluorobenzonitrile

2-Amino-5-fluorobenzonitrile structure

2-Amino-5-fluorobenzonitrile 

structure
  • CAS No:

    61272-77-3

  • Formula:

    C7H5FN2

  • Chemical Name:

    2-Amino-5-fluorobenzonitrile

  • Synonyms:

    5-FLUOROANTHRANILONITRILE;5-FLUOROANTHRONILONITRILE;2-AMINO-5-FLUOROBENZONITRILE;2-AMINO-5-FLUOROBENONITRILE;2-Amino-5-fluorobenzonitrile 98+%;2-Cyano-4-fluoroaniline, 5-Fluoroanthranilonitrile;2-AMino-5-fluorobenzonitrle;2-AMino-5-fluorobenzonitrile, 97+%

  • Categories:

    Organic Chemistry  >  Organic Fluorine Compound

Description

white to light yellow crystal powder

2-Amino-5-fluorobenzonitrile Basic Attributes

136.13

136.043671

DTXSID10372220

2926909090

Characteristics

49.8

1.7

1.3±0.1 g/cm3

92-96 °C(lit.)

138 °C15 mm Hg(lit.)

120.4±23.2 °C

1.560

Safety Information

3439

3

20/21/22

22-24/25

Xi

Irritant

P305 + P351 + P338

H319

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory.

2-Amino-5-fluorobenzonitrile Use and Manufacturing

General procedure: The azido compound (1 mmol) was added to the freshly prepared Fe(0) nanoparticles (3 mmol) in water (5 mL) in the same pot under constant stirring at room temperature under argon atmosphere. After completion of reaction (TLC) the mixture was extracted with ethyl acetate (3 X 10 mL) (all Fe-species remained around stirring bar). Evaporation of solvent and purification by short column chromatography provided the pure product which was properly characterized by spectroscopic (IR, A mixture of 5-fluoro-2-nitrobenzonitrile (9.7Og, 58mmol) and 10percent palladium on charcoal (Ig) in MeOH (20OmL) was stirred under an atmosphere of hydrogen for 5h. The mixture was filtered through a pad of celite and evaporated. The residue was triturated with Et

Computed Properties

Molecular Weight:136.13
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:136.04367633
Monoisotopic Mass:136.04367633
Topological Polar Surface Area:49.8
Heavy Atom Count:10
Complexity:160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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