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Home > Encyclopedia > 4-CHLORO-2-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE

4-CHLORO-2-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE

4-CHLORO-2-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE structure

4-CHLORO-2-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE 

structure
  • CAS No:

    99195-86-5

  • Formula:

    C8H3ClF3NS

  • Chemical Name:

    4-CHLORO-2-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE

  • Synonyms:

    4-CHLORO-2-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE;4-Chloro-1-isothiocyanato-2-(trifluoromethyl)benzene, 5-Chloro-2-isothiocyanatobenzotrifluoride;4-Chloro-2-(trifluoromethyl)phenylisothiocyanate98%

4-CHLORO-2-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE Basic Attributes

237.63

236.96300

DTXSID10371531

2930909090

Characteristics

44.4

4.09310

1.4g/cm3

118°C18mm

107.2ºC

1.524

Safety Information

IRRITANT

Xi

Harmful/Stench

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

Computed Properties

Molecular Weight:237.63
XLogP3:4.8
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:236.9626825
Monoisotopic Mass:236.9626825
Topological Polar Surface Area:44.4
Heavy Atom Count:14
Complexity:250
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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