Found 1 result

Search term: MF = 'C_{18}H_{19}D_{4}N_{5}O_{2}'
ChemSpider 2D Image | 1,3-Dimethyl-7-{2-[(1-phenyl-2-propanyl)amino](~2~H_4_)ethyl}-3,7-dihydro-1H-purine-2,6-dione | C18H19D4N5O2

1,3-Dimethyl-7-{2-[(1-phenyl-2-propanyl)amino](2H4)ethyl}-3,7-dihydro-1H-purine-2,6-dione

  • Molecular FormulaC18H19D4N5O2
  • Average mass345.432 Da
  • Monoisotopic mass345.210297 Da
  • ChemSpider ID62873248

  • Non-standard isotope - Non-standard isotope

More details:

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

1,3-Dimethyl-7-{2-[(1-phenyl-2-propanyl)amino](2H4)ethyl}-3,7-dihydro-1H-purin-2,6-dion [German] [ACD/IUPAC Name]
1,3-Dimethyl-7-{2-[(1-phenyl-2-propanyl)amino](2H4)ethyl}-3,7-dihydro-1H-purine-2,6-dione [ACD/IUPAC Name]
1,3-Diméthyl-7-{2-[(1-phényl-2-propanyl)amino](2H4)éthyl}-3,7-dihydro-1H-purine-2,6-dione [French] [ACD/IUPAC Name]
1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-[2-[(1-methyl-2-phenylethyl)amino]ethyl-1,1,2,2-d4]- [ACD/Index Name]
1141738-12-6 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 563.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.7±3.0 kJ/mol
Flash Point: 294.8±32.9 °C
Index of Refraction: 1.636
Molar Refractivity: 97.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.90
ACD/LogD (pH 5.5): -0.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.64
Polar Surface Area: 70 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 49.0±7.0 dyne/cm
Molar Volume: 270.5±7.0 cm3

Click to predict properties on the Chemicalize site


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