3-phenylpropanoic Acid

3-phenylpropanoic Acid bmse011949 - Data

3-phenylpropanoic Acid synonyms

Wikipedia:

Graphical representations:

3-phenylpropanoic

View large 3D structure

Molecular Formula: C9H10O2

Natural Isotopic Abundance Mass: 150.1745

Mono-Isotopic Molecular Masses:

  • C12N14: 150.06807956
  • C13N14: 159.09827310200004
  • C12N15: 150.06807956
  • C13N15: 159.09827310200004

InChI string: InChI=1S/C9H10O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)

IUPAC: b'3-Phenylpropanoic acid'

BMRB Ligand Expo: HCI
EU-OPENSCREEN: EOS102660

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)