ChemSpider 2D Image | 1-(5-Bromo-1-methyl-6-oxo-1,6-dihydro-3-pyridinyl)-3-(5-methyl-2-hexanyl)urea | C14H22BrN3O2

1-(5-Bromo-1-methyl-6-oxo-1,6-dihydro-3-pyridinyl)-3-(5-methyl-2-hexanyl)urea

  • Molecular FormulaC14H22BrN3O2
  • Average mass344.247 Da
  • Monoisotopic mass343.089539 Da
  • ChemSpider ID30386756

More details:

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

1-(5-Brom-1-methyl-6-oxo-1,6-dihydro-3-pyridinyl)-3-(5-methyl-2-hexanyl)harnstoff [German] [ACD/IUPAC Name]
1-(5-Bromo-1-methyl-6-oxo-1,6-dihydro-3-pyridinyl)-3-(5-methyl-2-hexanyl)urea [ACD/IUPAC Name]
1-(5-Bromo-1-méthyl-6-oxo-1,6-dihydro-3-pyridinyl)-3-(5-méthyl-2-hexanyl)urée [French] [ACD/IUPAC Name]
Urea, N-(5-bromo-1,6-dihydro-1-methyl-6-oxo-3-pyridinyl)-N'-(1,4-dimethylpentyl)- [ACD/Index Name]
1-(5-BROMO-1-METHYL-6-OXOPYRIDIN-3-YL)-3-(5-METHYLHEXAN-2-YL)UREA

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

Density: 1.3±0.1 g/cm3
Boiling Point: 393.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.3±3.0 kJ/mol
Flash Point: 191.8±27.9 °C
Index of Refraction: 1.560
Molar Refractivity: 83.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 16.25
ACD/KOC (pH 5.5): 256.03
ACD/LogD (pH 7.4): 1.89
ACD/BCF (pH 7.4): 16.21
ACD/KOC (pH 7.4): 255.49
Polar Surface Area: 61 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 46.0±5.0 dyne/cm
Molar Volume: 257.7±5.0 cm3

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