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4'-Benzyloxy-2'-hydroxyacetophenone

  • Name 4'-Benzyloxy-2'-hydroxyacetophenone
  • EINECSN/A
  • CAS No. 29682-12-0
  • Density1.187 g/cm3
  • PSA46.53000
  • LogP3.17380
  • SolubilityN/A
  • Melting Point104-106 °C
  • FormulaC15H14O3
  • Boiling Point415.7 °C at 760 mmHg
  • Molecular Weight242.274
  • Flash Point157.1 °C
  • Transport InformationN/A
  • Appearancewhite crystalline solid
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 29682-12-0 (4'-Benzyloxy-2'-hydroxyacetophenone)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data59

4'-Benzyloxy-2'-hydroxyacetophenone Specification

The 1-(2-Hydroxy-4-phenylmethoxy-phenyl)ethanone, with the CAS registry number 29682-12-0, is also known as NSC211460. It belongs to the product category of Aromatics. This chemical's molecular formula is C15H14O3 and molecular weight is 242.26986. Its IUPAC name is called 1-(2-hydroxy-4-phenylmethoxyphenyl)ethanone. What's more, this chemical is white crystalline solid.

Physical properties of 1-(2-Hydroxy-4-phenylmethoxy-phenyl)ethanone: (1)ACD/LogP: 3.81; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 5; (5)Index of Refraction: 1.594; (6)Molar Refractivity: 69.32 cm3; (7)Molar Volume: 204 cm3; (8)Surface Tension: 47.6 dyne/cm; (9)Density: 1.187 g/cm3; (10)Flash Point: 157.1 °C; (11)Enthalpy of Vaporization: 69.48 kJ/mol; (12)Boiling Point: 415.7 °C at 760 mmHg; (13)Vapour Pressure: 1.67E-07 mmHg at 25°C.

Preparation: this chemical can be prepared by chloromethyl-benzene and 1-(2,4-dihydroxy-phenyl)-ethanone. This reaction will need reagent K2CO3 and solvent dimethylformamide.

Uses of 1-(2-Hydroxy-4-phenylmethoxy-phenyl)ethanone: it can be used to produce 1-(4-benzyloxy-2,5-dihydroxy-phenyl)-ethanone. This reaction will need reagent 6percent aq. NaOH, 8.4percent aq. potassium persulfate and solvent pyridine with reaction time of 24 hours. The yield is about 25.8%.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)O
(2)InChI: InChI=1S/C15H14O3/c1-11(16)14-8-7-13(9-15(14)17)18-10-12-5-3-2-4-6-12/h2-9,17H,10H2,1H3
(3)InChIKey: AGQNLHOTLJFJCG-UHFFFAOYSA-N

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