P-hydroxyacetophenone

P-hydroxyacetophenone bmse000593 - Data bmse000670 - Data bmse010030 - Data

P_hydroxyacetophenone synonyms

4-Acetylphenol; (4-Hydroxyphenyl)ethan-1-one; P-HYDROXYACETOPHENONE; 4-Hydroxyacetophenone; ethanone, 1-(4-hydroxyphenyl)-; 4'-Hydroxyacetophenone; 1-(4-hydroxyphenyl)ethanone; Acetophenone, 4'-hydroxy-; 1-(4-Hydroxy-phenyl)-ethanone; p-Hydroxyacetophenone; Ethanone, 1-(4-hydroxyphenyl)-

Wikipedia:

Graphical representations:

p_hydroxyacetophenone

View large 3D structure

Molecular Formula: C8H8O2

Natural Isotopic Abundance Mass: 136.14792

Mono-Isotopic Molecular Masses:

  • C12N14: 136.052429501
  • C13N14: 144.0792682034
  • C12N15: 136.052429501
  • C13N15: 144.0792682034

InChI string: InChI=1S/C8H8O2/c1-6(9)7-2-4-8(10)5-3-7/h2-5,10H,1H3

PubChem Compound (CID): 7469
CAS Registry number: 99-93-4
Sigma-Aldrich: 278564_ALDRICH
EPA DSSTox: 39404
ZINC: ZINC00330136
UM-BBD: c0694
SMID: AC6
NMRShiftDB: 10008663
KEGG Compound ID: C10700
NIST Chemistry WebBook: 3419523591
MMCD: cq_07365
MDL: MFCD00002359
PDB Compound ID: AC6

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)