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Substance Name: Triadimenol [BSI:ISO]
RN: 55219-65-3
UNII: NFR7MRD9NM
InChIKey: BAZVSMNPJJMILC-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Fungicide
  • Fungicide, Bactericide, Wood Preservative

Molecular Formula

  • C14-H18-Cl-N3-O2

Molecular Weight

  • 295.768
 
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Names and Synonyms

Results Name

  • Triadimenol [BSI:ISO]

Name of Substance

  • Triadimenol
  • Triadimenol [BSI:ISO]

Synonyms

  • (1RS,2RS,1RS,2SR)-1-(4-Chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol (IUPAC)
  • 1-(4-Chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
  • 2-(4-Chlorophenoxy)-1-tert-butyl-2-(1H-1,2,4-triazole-1-yl)ethanol
  • Bay kwg 0519
  • Bayfidan
  • Bayfrdan EW
  • Baytan
  • Baytan 15
  • Baytan TF 3479B
  • beta-(4-Chlorophenoxy)-alpha-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol
  • Caswell No. 074A
  • EINECS 259-537-6
  • EPA Pesticide Chemical Code 127201
  • HSDB 7733
  • KWG 0519
  • Spinnaker
  • Summit
  • Triadimenol
  • Triafol
  • Triaphol
  • Tridan Fungicide
  • UK 199
  • UNII-NFR7MRD9NM

Systematic Names

  • 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-
  • alpha-tert-Butyl-beta-(4-chlorophenoxy)-1H-1,2,4-triazole-1-ethanol
  • Ethanol, 2-(4-chlorophenoxy)-1-tert-butyl-2-(1H-1,2,4-triazole-1-yl)-

Registry Numbers

CAS Registry Number

  • 55219-65-3

FDA UNII

  • NFR7MRD9NM

System Generated Number

  • 0055219653

Structure Descriptors

InChI

1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3

InChIKey

BAZVSMNPJJMILC-UHFFFAOYSA-N

Smiles

n1([C@@H](Oc2ccc(Cl)cc2)[C@@H](C(C)(C)C)O)cncn1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
bird - domestic LD50 oral > 1gm/kg (1000mg/kg)   "Agrochemicals Handbook," with updates, Hartley, D., and H. Kidd, eds., Nottingham, Royal Soc of Chemistry, 1983-86Vol. A402, Pg. 1985,
bird - domestic LD50 unreported > 10gm/kg (10000mg/kg)   Defense des Vegetaux. Vol. 36, Pg. 126, 1982.
chicken LD50 oral > 2gm/kg (2000mg/kg)   "Agrochemicals Handbook," with updates, Hartley, D., and H. Kidd, eds., Nottingham, Royal Soc of Chemistry, 1983-86Vol. A402, Pg. 1985,
chicken LDLo unreported > 2gm/kg (2000mg/kg)   Defense des Vegetaux. Vol. 39(235), Pg. 2, 1985.
mouse LC50 inhalation 3gm/m3 (3000mg/m3) BEHAVIORAL: MUSCLE WEAKNESS Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 55(9), Pg. 40, 1990.
mouse LD50 oral 3250mg/kg (3250mg/kg) BEHAVIORAL: MUSCLE WEAKNESS Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 55(9), Pg. 40, 1990.
quail LD50 oral > 10gm/kg (10000mg/kg)   "Agrochemicals Handbook," with updates, Hartley, D., and H. Kidd, eds., Nottingham, Royal Soc of Chemistry, 1983-86Vol. A402, Pg. 1985,
quail LDLo unreported > 10gm/kg (10000mg/kg)   Defense des Vegetaux. Vol. 39(235), Pg. 2, 1985.
rabbit LD50 oral 1500mg/kg (1500mg/kg) BEHAVIORAL: MUSCLE WEAKNESS Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 55(9), Pg. 40, 1990.
rat LC50 inhalation 3060mg/m3 (3060mg/m3) BEHAVIORAL: MUSCLE WEAKNESS Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 55(9), Pg. 40, 1990.
rat LD50 oral 3800mg/kg (3800mg/kg) BEHAVIORAL: MUSCLE WEAKNESS Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 55(9), Pg. 40, 1990.
rat LD50 skin > 5gm/kg (5000mg/kg)   Pesticide Manual. Vol. 9, Pg. 833, 1991.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 124 deg C   EXP
log P (octanol-water) 2.9 (none)   EXP
Water Solubility 120 mg/L 20 EXP
Vapor Pressure 3.10E-10 mm Hg 20 EXP
Henry's Law Constant 1.28E-12 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.18E-11 cm3/molecule-sec 25 EST

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