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Home > Encyclopedia > 3-[(Trifluoromethyl)thio]benzenamine

3-[(Trifluoromethyl)thio]benzenamine

3-[(Trifluoromethyl)thio]benzenamine structure

3-[(Trifluoromethyl)thio]benzenamine 

structure
  • CAS No:

    369-68-6

  • Formula:

    C7H6F3NS

  • Chemical Name:

    3-[(Trifluoromethyl)thio]benzenamine

  • Synonyms:

    Benzenamine,3-[(trifluoromethyl)thio]-;Aniline,m-[(trifluoromethyl)thio]-;3-[(Trifluoromethyl)thio]benzenamine;m-(Trifluoromethylthio)aniline;3-Trifluoromethylthioaniline;3-Aminophenyl trifluoromethyl sulfide;(3-((Trifluoromethyl)thio)phenyl)amine;3-(Trifluoromethylthio)benzenamine;3-Trifluoromethylsulfanylaniline

3-[(Trifluoromethyl)thio]benzenamine Basic Attributes

193.189

193.19

206-722-4

DTXSID9073171

2930909090

Characteristics

51.32000

2.32

1.4±0.1 g/cm3

108-110 °C @ Press: 5 Torr

60.5±27.3 °C

1.532

Immiscible with water.

Safety Information

III

6.1

2810

R20/21/22

S23-S36/37/39-S36/37-S26

T: Toxic;Xn: Harmful;

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501

H302

Computed Properties

Molecular Weight:193.19
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:193.01730486
Monoisotopic Mass:193.01730486
Topological Polar Surface Area:51.3
Heavy Atom Count:12
Complexity:148
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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