ChemSpider 2D Image | 2-Methyl-4-{5-[6-(trifluoromethyl)-4-pyrimidinyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl}-6,7-dihydro-5H-cyclopenta[d]pyrimidine | C19H21F3N6

2-Methyl-4-{5-[6-(trifluoromethyl)-4-pyrimidinyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl}-6,7-dihydro-5H-cyclopenta[d]pyrimidine

  • Molecular FormulaC19H21F3N6
  • Average mass390.405 Da
  • Monoisotopic mass390.177979 Da
  • ChemSpider ID114880936

More details:

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

2-Methyl-4-{5-[6-(trifluormethyl)-4-pyrimidinyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl}-6,7-dihydro-5H-cyclopenta[d]pyrimidin [German] [ACD/IUPAC Name]
2-Methyl-4-{5-[6-(trifluoromethyl)-4-pyrimidinyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl}-6,7-dihydro-5H-cyclopenta[d]pyrimidine [ACD/IUPAC Name]
2-Méthyl-4-{5-[6-(trifluorométhyl)-4-pyrimidinyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl}-6,7-dihydro-5H-cyclopenta[d]pyrimidine [French] [ACD/IUPAC Name]
5H-Cyclopenta[d]pyrimidine, 4-[hexahydro-5-[6-(trifluoromethyl)-4-pyrimidinyl]pyrrolo[3,4-c]pyrrol-2(1H)-yl]-6,7-dihydro-2-methyl- [ACD/Index Name]
2741955-03-1 [RN]
2-methyl-4-[2-[6-(trifluoromethyl)pyrimidin-4-yl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine
4-(5-{2-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}-octahydropyrrolo[3,4-c]pyrrol-2-yl)-6-(trifluoromethyl)pyrimidine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 552.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 287.7±30.1 °C
Index of Refraction: 1.589
Molar Refractivity: 96.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 0.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.75
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 9.80
ACD/KOC (pH 7.4): 101.88
Polar Surface Area: 58 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 55.1±3.0 dyne/cm
Molar Volume: 285.2±3.0 cm3

Click to predict properties on the Chemicalize site


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