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Substance Name: Flurtamone [ISO:ANSI:BSI]
RN: 96525-23-4
UNII: U2379SGQ8L
InChIKey: NYRMIJKDBAQCHC-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Herbicide
  • Tumor Data

Molecular Formula

  • C18-H14-F3-N-O2

Molecular Weight

  • 333.3076
 
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Names and Synonyms

Name of Substance

  • Flurtamone [ISO:ANSI:BSI]

Synonyms

  • (+-)-5-(Methylamino)-2-phenyl-4-(3-(trifluoromethyl)phenyl)-3(2H)-furanone
  • Benchmark
  • Flurtamone
  • RE 40885
  • UNII-U2379SGQ8L

Systematic Names

  • 3(2H)-Furanone, 5-(methylamino)-2-phenyl-4-(3-(trifluoromethyl)phenyl)-
  • 3(2H)-Furanone, 5-(methylamino)-2-phenyl-4-(3-(trifluoromethyl)phenyl)-, (+-)-

Registry Numbers

CAS Registry Number

  • 96525-23-4

FDA UNII

  • U2379SGQ8L

System Generated Number

  • 0096525234

Structure Descriptors

InChI

1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3

InChIKey

NYRMIJKDBAQCHC-UHFFFAOYSA-N

Smiles

CNC1=C(C(=O)C(O1)c2ccccc2)c3cccc(c3)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 500mg/kg (500mg/kg)   Farm Chemicals Handbook. Vol. -, Pg. C40, 1991.
rat LD50 skin > 500mg/kg (500mg/kg)   Farm Chemicals Handbook. Vol. -, Pg. C40, 1991.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 152.5 deg C   EXP
log P (octanol-water) 3.22 (none)   EXP
Water Solubility 35 mg/L 20 EXP
Vapor Pressure 3.15E-07 mm Hg 25 EST
Henry's Law Constant 1.69E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.92E-11 cm3/molecule-sec 25 EST

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