Found 1 result

Search term: MF = 'C_{18}H_{16}D_{6}ClFN_{2}O_{3}'
ChemSpider 2D Image | d6-flurpiridaz | C18H16D6ClFN2O3

d6-flurpiridaz

  • Molecular FormulaC18H16D6ClFN2O3
  • Average mass374.867 Da
  • Monoisotopic mass374.167969 Da
  • ChemSpider ID24706881

  • Non-standard isotope - Non-standard isotope

More details:

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

3(2H)-Pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-[[[4-[[(2-fluoroethyl-1,1,2,2-d4)oxy]methyl]phenyl]methyl-d2]oxy]- [ACD/Index Name]
4-Chlor-5-({[4-({[2-fluor(2H4)ethyl]oxy}methyl)phenyl](2H2)methyl}oxy)-2-(2-methyl-2-propanyl)-3(2H)-pyridazinon [German] [ACD/IUPAC Name]
4-Chloro-5-({[4-({[2-fluoro(2H4)ethyl]oxy}methyl)phenyl](2H2)methyl}oxy)-2-(2-methyl-2-propanyl)-3(2H)-pyridazinone [ACD/IUPAC Name]
4-Chloro-5-({[4-({[2-fluoro(2H4)éthyl]oxy}méthyl)phényl](2H2)méthyl}oxy)-2-(2-méthyl-2-propanyl)-3(2H)-pyridazinone [French] [ACD/IUPAC Name]
d6-flurpiridaz
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL494623/

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 486.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.2±3.0 kJ/mol
Flash Point: 248.1±31.5 °C
Index of Refraction: 1.536
Molar Refractivity: 95.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.41
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 63.06
ACD/KOC (pH 5.5): 675.89
ACD/LogD (pH 7.4): 2.67
ACD/BCF (pH 7.4): 63.06
ACD/KOC (pH 7.4): 675.89
Polar Surface Area: 51 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 37.8±7.0 dyne/cm
Molar Volume: 306.0±7.0 cm3

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