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Substance Name: 2-Propanone, 1,1-diphenyl-
RN: 781-35-1
InChIKey: DBNWBEGCONIRGQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H14-O

Molecular Weight

  • 210.275
 
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Names and Synonyms

Synonyms

  • 1,1-Diphenyl acetone
  • 1,1-Diphenyl-2-propanone
  • 1,1-Diphenylacetone
  • 4-07-00-01426 (Beilstein Handbook Reference)
  • AI3-11041
  • Benzhydryl methyl ketone
  • BRN 1910206
  • EINECS 212-307-9
  • Ketone, diphenylmethyl methyl
  • Methyl diphenylmethyl ketone
  • NSC 400472

Systematic Names

  • 1,1-Diphenylacetone
  • 2-Propanone, 1,1-diphenyl-

Registry Numbers

CAS Registry Number

  • 781-35-1

System Generated Number

  • 0000781351

Structure Descriptors

InChI

1S/C15H14O/c1-12(16)15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15H,1H3

InChIKey

DBNWBEGCONIRGQ-UHFFFAOYSA-N

Smiles

O=C(C(c1ccccc1)c1ccccc1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 21, Pg. 1326, 1987.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 46 deg C   EXP
Boiling Point 307 deg C   EXP
log P (octanol-water) 3.110 (none)   EST
Atmospheric OH Rate Constant 1.08E-11 cm3/molecule-sec 25 EST

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