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Home > Encyclopedia > 4-Chloro-2-fluorobenzonitrile

4-Chloro-2-fluorobenzonitrile

4-Chloro-2-fluorobenzonitrile structure

4-Chloro-2-fluorobenzonitrile 

structure
  • CAS No:

    57381-51-8

  • Formula:

    C7H3ClFN

  • Chemical Name:

    4-Chloro-2-fluorobenzonitrile

  • Synonyms:

    Benzonitrile,4-chloro-2-fluoro-;4-Chloro-2-fluorobenzonitrile;2-Fluoro-4-chlorobenzonitrile

  • Categories:

    Organic Chemistry  >  Organic Fluorine Compound

Description

white to off-white crystalline powder

4-Chloro-2-fluorobenzonitrile Basic Attributes

155.56

155.56

4231142

260-712-4

DTXSID80205975

2926909090

Characteristics

23.8

2.4

1.3±0.1 g/cm3

57-58 °C @ Solvent: 2,2,4-Trimethylpentane

92/22mm

79.2±21.8 °C

1.537

H2O: insoluble

Safety Information

6.1

3439

36/37/38-20/21/22-36/38

36/37/39-26-36-36/37

Xn,T

Toxic

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, P501

H301

|Danger|H301 (37.5%): 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 8 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:155.55
XLogP3:2.4
Hydrogen Bond Acceptor Count:2
Exact Mass:154.9938050
Monoisotopic Mass:154.9938050
Topological Polar Surface Area:23.8
Heavy Atom Count:10
Complexity:162
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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