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Home > Encyclopedia > (1,1,1-trifluoro-4-oxo-4-phenylbut-2-en-2-yl) acetate

(1,1,1-trifluoro-4-oxo-4-phenylbut-2-en-2-yl) acetate

(1,1,1-trifluoro-4-oxo-4-phenylbut-2-en-2-yl) acetate structure

(1,1,1-trifluoro-4-oxo-4-phenylbut-2-en-2-yl) acetate 

structure
  • CAS No:

    149172-65-6

  • Formula:

    C12H9F3O3

  • Chemical Name:

    (1,1,1-trifluoro-4-oxo-4-phenylbut-2-en-2-yl) acetate

  • Synonyms:

    1-Benzoyl-2-trifluoromethyl-2-acetoxyethene;

(1,1,1-trifluoro-4-oxo-4-phenylbut-2-en-2-yl) acetate Basic Attributes

258.19300

258.05037863 g/mol

Characteristics

43.37000

2.87860

1.289g/cm3

297.6ºC

129.6ºC

1.48

0.00134mmHg at 25°C

Drug Information

1-benzoyl-2-trifluoromethyl-2-acetoxyethene

Computed Properties

Molecular Weight:258.19
XLogP3:2.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:258.05037863
Monoisotopic Mass:258.05037863
Topological Polar Surface Area:43.4
Heavy Atom Count:18
Complexity:352
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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