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Substance Name: Dibenzoylmethane
RN: 120-46-7
UNII: ANS7ME8OKC
InChIKey: NZZIMKJIVMHWJC-UHFFFAOYSA-N

Molecular Formula

  • C15-H12-O2

Molecular Weight

  • 224.258
 
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Names and Synonyms

Name of Substance

  • Dibenzoylmethane

Synonyms

  • 1,3-Diphenyl-1,3-propanedione
  • 2-Benzoylacetophenone
  • AI3-19022
  • BRN 0514910
  • CCRIS 8445
  • Dibenzoylmethane
  • EC 204-398-9
  • EINECS 204-398-9
  • Karenzu DK2
  • NSC 6266
  • omega-Benzoylacetophenone
  • Phenyl phenacyl ketone
  • Rhodiastab 83
  • UNII-ANS7ME8OKC

Systematic Names

  • 1,3-Diphenylpropane-1,3-dione
  • 1,3-Propanedione, 1,3-diphenyl-

Registry Numbers

CAS Registry Number

  • 120-46-7

FDA UNII

  • ANS7ME8OKC

Other Registry Number

  • 61346-73-4

System Generated Number

  • 0000120467

Structure Descriptors

InChI

1S/C15H12O2/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13/h1-10H,11H2

InChIKey

NZZIMKJIVMHWJC-UHFFFAOYSA-N

Smiles

c1(C(CC(c2ccccc2)=O)=O)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD oral > 500mg/kg (500mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 28, 1953.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 70.5 deg C   EXP
log P (octanol-water) 2.510 (none)   EST
Atmospheric OH Rate Constant 4.08E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.