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Home > Encyclopedia > 2-[[3-(Trifluoromethyl)phenyl]thio]acetic acid

2-[[3-(Trifluoromethyl)phenyl]thio]acetic acid

2-[[3-(Trifluoromethyl)phenyl]thio]acetic acid structure

2-[[3-(Trifluoromethyl)phenyl]thio]acetic acid 

structure
  • CAS No:

    349-83-7

  • Formula:

    C9H7F3O2S

  • Chemical Name:

    2-[[3-(Trifluoromethyl)phenyl]thio]acetic acid

  • Synonyms:

    Acetic acid,2-[[3-(trifluoromethyl)phenyl]thio]-;Acetic acid,[(α,α,α-trifluoro-m-tolyl)thio]-;Acetic acid,[[3-(trifluoromethyl)phenyl]thio]-;2-[[3-(Trifluoromethyl)phenyl]thio]acetic acid;[[3-(Trifluoromethyl)phenyl]sulfanyl]acetic acid;2-[[3-(Trifluoromethyl)phenyl]sulfanyl]acetic acid

2-[[3-(Trifluoromethyl)phenyl]thio]acetic acid Basic Attributes

236.21100

236.21

2930909090

Characteristics

62.60000

2.88210

1.44g/cm3

105-107ºC

105-107ºC

139.8ºC

Safety Information

36/37/38

26-36/37/39

Xi: Irritant;

Computed Properties

Molecular Weight:236.21
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:236.01188512
Monoisotopic Mass:236.01188512
Topological Polar Surface Area:62.6
Heavy Atom Count:15
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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