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Substance Name: 2,4,5-Trihydroxybutyrophenone
RN: 1421-63-2
UNII: KN729W3LR0
InChIKey: SRUQARLMFOLRDN-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C10-H12-O4

Molecular Weight

  • 196.2008
 
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Names and Synonyms

Name of Substance

  • 2,4,5-Trihydroxybutyrophenone

Synonyms

  • 1-(2,4,5-Trihydroxyphenyl)-1-butanone
  • 1-Butanone, 1-(2,4,5-trihydroxyphenyl)-
  • 2',4',5'-Trihydroxybutyrophenone
  • 2,4,5-Trihydroxybutyrophenone
  • 4-08-00-02753 (Beilstein Handbook Reference)
  • AI3-26870
  • BRN 2577028
  • Butyrophenone, 2',4',5'-trihydroxy-
  • CCRIS 6281
  • EINECS 215-824-8
  • HSDB 4288
  • NSC 73478
  • Thbp
  • UNII-KN729W3LR0
  • USAF EK

Systematic Names

  • 1-Butanone, 1-(2,4,5-trihydroxyphenyl)-
  • 2',4',5'-Trihydroxybutyrophenone
  • Butyrophenone, 2',4',5'-trihydroxy-

Superlist Name

  • 2',4',5'-Trihydroxybutyrophenone

Registry Numbers

CAS Registry Number

  • 1421-63-2

FDA UNII

  • KN729W3LR0

System Generated Number

  • 0001421632

Structure Descriptors

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

SRUQARLMFOLRDN-UHFFFAOYSA-N

Smiles

CCCC(=O)c1cc(c(cc1O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   National Technical Information Service. Vol. AD277-689,