2′,4′,5′-Trihydroxybutyrophenone

CAS Registry Number®

1421-63-2
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CAS Name

2′,4′,5′-Trihydroxybutyrophenone

Molecular Formula

C10H12O4

Molecular Mass

196.20

Cite this Page

2′,4′,5′-Trihydroxybutyrophenone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1421-63-2 (retrieved 2024-04-19) (CAS RN: 1421-63-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    149-153 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C10H12O4/c1-2-3-7(11)6-4-9(13)10(14)5-8(6)12/h4-5,12-14H,2-3H2,1H3

InChIKey

InChIKey=SRUQARLMFOLRDN-UHFFFAOYSA-N

SMILES

C(CCC)(=O)C1=C(O)C=C(O)C(O)=C1

Canonical SMILES

O=C(C1=CC(O)=C(O)C=C1O)CCC

Other Names for this Substance

  • 1-Butanone, 1-(2,4,5-trihydroxyphenyl)-
  • Butyrophenone, 2′,4′,5′-trihydroxy-
  • 1-(2,4,5-Trihydroxyphenyl)-1-butanone
  • THBP
  • 2′,4′,5′-Trihydroxybutyrophenone

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