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Home > Encyclopedia > Benzonitrile, 4-(2,2,2-trifluoro-1-hydroxyethyl)- (9CI)

Benzonitrile, 4-(2,2,2-trifluoro-1-hydroxyethyl)- (9CI)

Benzonitrile, 4-(2,2,2-trifluoro-1-hydroxyethyl)- (9CI) structure

Benzonitrile, 4-(2,2,2-trifluoro-1-hydroxyethyl)- (9CI) 

structure
  • CAS No:

    107018-37-1

  • Formula:

    C9H6F3NO

  • Chemical Name:

    Benzonitrile, 4-(2,2,2-trifluoro-1-hydroxyethyl)- (9CI)

  • Synonyms:

    4-(2,2,2-trifluoro-1-hydroxyethyl)benzonitrile;4-(2,2,2-trifluoro-1-hydroxy-ethyl)benzonitrile;SCHEMBL2423417;4-(2,2,2-TRIFLUORO-1-HYDROXYETHYL)-BENZONITRILE;DTXSID50471322;AKOS010909279;1-(4-Cyanophenyl)-2,2,2-trifluoroethanol;J-513249

Benzonitrile, 4-(2,2,2-trifluoro-1-hydroxyethyl)- (9CI) Basic Attributes

201.1452496

201.04

DTXSID50471322

2926909090

Characteristics

44

1.9

Computed Properties

Molecular Weight:201.14
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:201.04014830
Monoisotopic Mass:201.04014830
Topological Polar Surface Area:44
Heavy Atom Count:14
Complexity:234
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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