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Home > Encyclopedia > 3-FLUORO-5-(TRIFLUOROMETHYL)PHENYLACETONITRILE

3-FLUORO-5-(TRIFLUOROMETHYL)PHENYLACETONITRILE

3-FLUORO-5-(TRIFLUOROMETHYL)PHENYLACETONITRILE structure

3-FLUORO-5-(TRIFLUOROMETHYL)PHENYLACETONITRILE 

structure
  • CAS No:

    239087-12-8

  • Formula:

    C9H5F4N

  • Chemical Name:

    3-FLUORO-5-(TRIFLUOROMETHYL)PHENYLACETONITRILE

  • Synonyms:

    3-Fluoro-5-(trifluoromethyl)phenylacetonitrile 98%;3-Fluoro-5-(trifluoromethyl)phenylacetonitrile98%;3-Fluoro-5-trifluoromethylbenzyl cyanide;3-FLUORO-5-(TRIFUOROMETHYL)PHENYLACETONITRILE ;3-Fluoro-5-(trifluoromethyl)benzyl cyanide, 3-(Cyanomethyl)-5-fluorobenzotrifluoride;2-(3-fluoro-5-(trifluoromethyl)phenyl)acetonitrile;3-FLUORO-5-(TRIFLUOROMETHYL)PHENYLACETONITRILE;Benzeneacetonitrile, 3-fluoro-5-(trifluoromethyl)-

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

3-FLUORO-5-(TRIFLUOROMETHYL)PHENYLACETONITRILE Basic Attributes

203.14

203.03581181

DTXSID40372172

2926909090

Characteristics

23.79000

2.91058

1.32g/ml

205.8±35.0 °C(Predicted)

89.6ºC

1.443

0.245mmHg at 25°C

Safety Information

TOXIC

3276

20/21/22-36/37/38

26-36/37/39-45

T

Computed Properties

Molecular Weight:203.14
XLogP3:2.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:203.03581181
Monoisotopic Mass:203.03581181
Topological Polar Surface Area:23.8
Heavy Atom Count:14
Complexity:239
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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