[4-(benzimidazol-1-yl)phenyl]methanol

[4-(benzimidazol-1-yl)phenyl]methanol bmse011062 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C14H12N2O

Natural Isotopic Abundance Mass: 224.25787999999986

Mono-Isotopic Molecular Masses:

  • C12N14: 224.094963014
  • C13N14: 238.14193074600007
  • C12N15: 226.0890328
  • C13N15: 240.13600053200008

InChI string: InChI=1S/C14H12N2O/c17-9-11-5-7-12(8-6-11)16-10-15-13-3-1-2-4-14(13)16/h1-8,10,17H,9H2

IUPAC: [4-(benzimidazol-1-yl)phenyl]methanol

wwPDB CCD: JFS

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)