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Fluoro(phenylthio)acetonitrile

Fluoro(phenylthio)acetonitrile structure

Fluoro(phenylthio)acetonitrile 

structure
  • CAS No:

    130612-84-9

  • Formula:

    C8H6FNS

  • Chemical Name:

    Fluoro(phenylthio)acetonitrile

  • Synonyms:

    2-fluoro-2-phenylsulfanylacetonitrile;

Fluoro(phenylthio)acetonitrile Basic Attributes

167.20300

167.02049853

DTXSID10576064

2930909090

Characteristics

49.09000

2.59788

1.22g/cm3

223.1ºC at 760 mmHg

88.8ºC

1.557

0.0978mmHg at 25°C

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:167.21
XLogP3:2.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:167.02049853
Monoisotopic Mass:167.02049853
Topological Polar Surface Area:49.1
Heavy Atom Count:11
Complexity:157
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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