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Home > Encyclopedia > 4-(4-Fluorophenyl)benzonitrile

4-(4-Fluorophenyl)benzonitrile

4-(4-Fluorophenyl)benzonitrile structure

4-(4-Fluorophenyl)benzonitrile 

structure
  • CAS No:

    10540-31-5

  • Formula:

    C13H8FN

  • Chemical Name:

    4-(4-Fluorophenyl)benzonitrile

  • Synonyms:

    4-(4-FLUOROPHENYL)BENZONITRILE97;4-FLUORO-4''-DIBENZONOTRILE;4-(4-Fluorophenyl)benzonitrile;FCB

  • Categories:

    Organic Chemistry  >  Organic Fluorine Compound

4-(4-Fluorophenyl)benzonitrile Basic Attributes

197.21

197.06400

DTXSID40362659

2926909090

Characteristics

23.8

3.36438

1.19g/cm3

112-116 °C(lit.)

329.6ºC at 760 mmHg

166.1ºC

1.595

Safety Information

UN 3077 9/PG 3

3

37/38-41-50/53

26-39-60-61

Xi,N

P261-P273-P280-P305 + P351 + P338

H315-H318-H335-H400

|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:197.21
XLogP3:4.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:197.064077422
Monoisotopic Mass:197.064077422
Topological Polar Surface Area:23.8
Heavy Atom Count:15
Complexity:239
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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