ChemSpider 2D Image | MFCD27992127 | C14H14D4ClN3O2

MFCD27992127

  • Molecular FormulaC14H14D4ClN3O2
  • Average mass299.789 Da
  • Monoisotopic mass299.133850 Da
  • ChemSpider ID30773533
  • Non-standard isotope - Non-standard isotope


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-{[4-Chlor(2H4)phenyl]oxy}-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanol [German] [ACD/IUPAC Name]
1-{[4-Chloro(2H4)phenyl]oxy}-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanol [ACD/IUPAC Name]
1-{[4-Chloro(2H4)phényl]oxy}-3,3-diméthyl-1-(1H-1,2,4-triazol-1-yl)-2-butanol [French] [ACD/IUPAC Name]
1H-1,2,4-Triazole-1-ethanol, β-[(4-chlorophenyl-2,3,5,6-d4)oxy]-α-(1,1-dimethylethyl)- [ACD/Index Name]
MFCD27992127
Triadimenol-(4-chlorophenoxy-d4)
Triadimenol-d4
α-tert-Butyl-β-(4-chlorophenoxy-d4)-1H-1,2,4-triazole-1-ethanol
1-(4-Chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)-2-butanol [ACD/IUPAC Name]
2121989-56-6 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 465.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 235.3±31.5 °C
Index of Refraction: 1.580
Molar Refractivity: 78.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.04
ACD/LogD (pH 5.5): 3.05
ACD/BCF (pH 5.5): 121.97
ACD/KOC (pH 5.5): 1083.60
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 122.04
ACD/KOC (pH 7.4): 1084.23
Polar Surface Area: 60 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 42.4±7.0 dyne/cm
Molar Volume: 237.1±7.0 cm3

Click to predict properties on the Chemicalize site






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