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Substance Name: Acrylophenone, 3-(2-furyl)-
RN: 717-21-5
InChIKey: BVAGSGSYUAOFPJ-CMDGGOBGSA-N

Molecular Formula

  • C13-H10-O2

Molecular Weight

  • 198.22
 
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Names and Synonyms

Synonyms

  • 3-(2-Furanyl)-1-phenyl-2-propen-1-one
  • 3-(2-Furyl)acrylophenone
  • 5-17-10-00371 (Beilstein Handbook Reference)
  • AI3-04601
  • BRN 0134154
  • EINECS 211-940-8
  • Furfurylideneacetophenone
  • NSC 2049

Systematic Names

  • 2-Propen-1-one, 3-(2-furanyl)-1-phenyl- (9CI)
  • 3-(2-Furyl)acrylophenone
  • Acrylophenone, 3-(2-furyl)-

Registry Numbers

CAS Registry Number

  • 717-21-5

System Generated Number

  • 0000717215

Structure Descriptors

InChI

1S/C13H10O2/c14-13(11-5-2-1-3-6-11)9-8-12-7-4-10-15-12/h1-10H/b9-8+

InChIKey

BVAGSGSYUAOFPJ-CMDGGOBGSA-N

Smiles

c1(C(\C=C\c2ccco2)=O)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04580,
rat LD oral > 500mg/kg (500mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 24, 1953.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 47 deg C   EXP
Boiling Point 317 deg C   EXP
log P (octanol-water) 3.030 (none)   EST
Atmospheric OH Rate Constant 5.96E-11 cm3/molecule-sec 25 EST

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