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Substance Name: Difenoconazole [ISO]
RN: 119446-68-3
UNII: D9612XCH4P
InChIKey: BQYJATMQXGBDHF-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Fungicide, Bactericide, Wood Preservative
  • Fungicides, Industrial
  • Pesticides

Molecular Formula

  • C19-H17-Cl2-N3-O3

Molecular Weight

  • 406.267
 
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Names and Synonyms

Results Name

  • Difenoconazole [ISO]

Name of Substance

  • Difenoconazole
  • Difenoconazole [ISO]

Synonyms

  • 1-((2-(2-Chloro-4-(4-chlorophenoxy)phenyl)-4-methyl-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole
  • 1h-1,2,4-triazole,1-((2-(2-chloro-4(4-chlorophenoxy)phenyl)-4-methyl-1,3-dioxolan-2-yl)methyl)-
  • Bardos Neu
  • CGA 169374
  • Difenoconazole
  • Dividend
  • Dividend (fungicide)
  • Dragon
  • HSDB 8370
  • Plover
  • Score
  • Score EC 250
  • UNII-D9612XCH4P

Systematic Name

  • 1H-1,2,4-Triazole, 1-((2-(2-chloro-4-(4-chlorophenoxy)phenyl)-4-methyl-1,3-dioxolan-2-yl)methyl)-

Registry Numbers

CAS Registry Number

  • 119446-68-3

FDA UNII

  • D9612XCH4P

Other Registry Number

  • 1135441-03-0

System Generated Number

  • 0119446683

Structure Descriptors

InChI

1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3

InChIKey

BQYJATMQXGBDHF-UHFFFAOYSA-N

Smiles

O1C[C@@H](C)O[C@@]1(Cn1ncnc1)c1c(Cl)cc(Oc2ccc(Cl)cc2)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
duck LD50 oral > 2150mg/kg (2150mg/kg)   Pesticide Manual. Vol. 9, Pg. 277, 1991.
rabbit LD50 skin > 2010mg/kg (2010mg/kg)   Pesticide Manual. Vol. 9, Pg. 277, 1991.
rat LC50 inhalation > 45mg/m3/4H (45mg/m3)   Pesticide Manual. Vol. 9, Pg. 277, 1991.
rat LD50 oral 1453mg/kg (1453mg/kg)   Pesticide Manual. Vol. 9, Pg. 277, 1991.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 76 deg C   EXP
log P (octanol-water) 4.3 (none)   EXP
Water Solubility 15 mg/L 25 EXP
Vapor Pressure 2.50E-10 mm Hg 25 EXP
Henry's Law Constant 8.91E-12 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.16E-11 cm3/molecule-sec 25 EST

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