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Search term: LLRJQFMAXXADBL-UHFFFAOYSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | N-Hexyl-2,4-dioxo-5-(trifluoromethyl)-3,4-dihydro-1(2H)-pyrimidinecarboxamide | C12H16F3N3O3

N-Hexyl-2,4-dioxo-5-(trifluoromethyl)-3,4-dihydro-1(2H)-pyrimidinecarboxamide

  • Molecular FormulaC12H16F3N3O3
  • Average mass307.269 Da
  • Monoisotopic mass307.114380 Da
  • ChemSpider ID29420446

More details:






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

1(2H)-Pyrimidinecarboxamide, N-hexyl-3,4-dihydro-2,4-dioxo-5-(trifluoromethyl)- [ACD/Index Name]
N-Hexyl-2,4-dioxo-5-(trifluormethyl)-3,4-dihydro-1(2H)-pyrimidincarboxamid [German] [ACD/IUPAC Name]
N-Hexyl-2,4-dioxo-5-(trifluoromethyl)-3,4-dihydro-1(2H)-pyrimidinecarboxamide [ACD/IUPAC Name]
N-Hexyl-2,4-dioxo-5-(trifluorométhyl)-3,4-dihydro-1(2H)-pyrimidinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.477
Molar Refractivity: 66.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 3.15
ACD/BCF (pH 5.5): 140.73
ACD/KOC (pH 5.5): 1146.30
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 12.42
ACD/KOC (pH 7.4): 101.18
Polar Surface Area: 79 Å2
Polarizability: 26.2±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 233.5±3.0 cm3

Click to predict properties on the Chemicalize site






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