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Home > Encyclopedia > 5-FLUORO-2-NITROBENZONITRILE

5-FLUORO-2-NITROBENZONITRILE

5-FLUORO-2-NITROBENZONITRILE structure

5-FLUORO-2-NITROBENZONITRILE 

structure
  • CAS No:

    50594-78-0

  • Formula:

    C7H3FN2O2

  • Chemical Name:

    5-FLUORO-2-NITROBENZONITRILE

  • Synonyms:

    5-Fluoro-2-nitrobenzonitrile 98%;5-Fluoro-2-nitrobenzonitrile98%;2-Cyano-4-fluoro-1-nitrobenzene;5-FLUORO-2-NITROBENZONITRILE;2-Cyano-4-fluoronitrobenzene;Benzonitrile, 5-fluoro-2-nitro-

5-FLUORO-2-NITROBENZONITRILE Basic Attributes

166.11

166.01785550

642-493-0

DTXSID90395992

Characteristics

69.61000

2.12878

1.41±0.1 g/cm3

84-88°C

302.9±27.0 °C(Predicted)

137ºC

1.553

Keep Cold

Safety Information

6.1

3439

20/21/22

26-36/37/39

Xi

|Danger|H301 (14.29%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 7 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:166.11
XLogP3:1.4
Hydrogen Bond Acceptor Count:4
Exact Mass:166.01785550
Monoisotopic Mass:166.01785550
Topological Polar Surface Area:69.6
Heavy Atom Count:12
Complexity:229
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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