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Substance Name: Flupoxam [ISO:BSI]
RN: 119126-15-7
UNII: G7Q93JFI8D
InChIKey: AOQMRUTZEYVDIL-UHFFFAOYSA-N

Molecular Formula

  • C19-H14-Cl-F5-N4-O2

Molecular Weight

  • 460.789
 
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Names and Synonyms

Name of Substance

  • Flupoxam [ISO:BSI]

Synonyms

  • EC 411-750-7
  • Flupoxam
  • UNII-G7Q93JFI8D

Systematic Names

  • 1-(4-Chloro-3-((2,2,3,3,3-pentafluoropropoxy)methyl)phenyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide
  • 1H-1,2,4-Triazole-3-carboxamide, 1-(4-chloro-3-((2,2,3,3,3-pentafluoropropoxy)methyl)phenyl)-5-phenyl-

Registry Numbers

CAS Registry Number

  • 119126-15-7

FDA UNII

  • G7Q93JFI8D

System Generated Number

  • 0119126157

Structure Descriptors

InChI

1S/C19H14ClF5N4O2/c20-14-7-6-13(8-12(14)9-31-10-18(21,22)19(23,24)25)29-17(11-4-2-1-3-5-11)27-16(28-29)15(26)30/h1-8H,9-10H2,(H2,26,30)

InChIKey

AOQMRUTZEYVDIL-UHFFFAOYSA-N

Smiles

n1c(C(=O)N)nc(c2ccccc2)n1c1cc(COCC(F)(F)C(F)(F)F)c(Cl)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 146 deg C   EXP
Water Solubility 1 mg/L 20 EXP
Vapor Pressure 1.50E-07 mm Hg 25 EXP
Henry's Law Constant 9.10E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.75E-12 cm3/molecule-sec 25 EST

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