3-(2-Hydroxyphenyl)propionic Acid

3-(2-Hydroxyphenyl)propionic Acid bmse000331 - Data

3-(2-Hydroxyphenyl)propionic synonyms

2-Hydroxyphenylpropanoate; 3-(2-hydroxyphenyl)propanoic acid; Melilotate; 2-hydroxybenzenepropanoic acid; Melilotic acid; melilotic acid; 3-(o-Hydroxyphenyl) propionic acid; MELILOTATE; 3-(2-Hydroxyphenyl) propionate; 3-(2-Hydroxyphenyl)propionate; Benzenepropanoic acid, 2-hydroxy-

Wikipedia:

Graphical representations:

3-(2-Hydroxyphenyl)propionic

View large 3D structure

Molecular Formula: C9H10O3

Natural Isotopic Abundance Mass: 166.1739

Mono-Isotopic Molecular Masses:

  • C12N14: 166.0629941873
  • C13N14: 175.0931877275
  • C12N15: 166.0629941873
  • C13N15: 175.0931877275

InChI string: InChI=1S/C9H10O3/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-4,10H,5-6H2,(H,11,12)

PubChem Compound (CID): 873
CAS Registry number: 495-78-3
Thomson Pharma: 01418127
ChemIDplus: 000495783
BioCyc: MELILOTATE
ChEBI: CHEBI:16104
CambridgeSoft Corporation: 6136
KEGG Compound ID: C01198
Sigma-Aldrich: 393533_ALDRICH

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)