ChemSpider 2D Image | 2,4-Dichloro-6-propyl-6H-pyrrolo[3,4-d]pyrimidine | C9H9Cl2N3

2,4-Dichloro-6-propyl-6H-pyrrolo[3,4-d]pyrimidine

  • Molecular FormulaC9H9Cl2N3
  • Average mass230.094 Da
  • Monoisotopic mass229.017349 Da
  • ChemSpider ID30774647

More details:






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

2,4-Dichlor-6-propyl-6H-pyrrolo[3,4-d]pyrimidin [German] [ACD/IUPAC Name]
2,4-Dichloro-6-propyl-6H-pyrrolo[3,4-d]pyrimidine [ACD/IUPAC Name]
2,4-Dichloro-6-propyl-6H-pyrrolo[3,4-d]pyrimidine [French] [ACD/IUPAC Name]
6H-Pyrrolo[3,4-d]pyrimidine, 2,4-dichloro-6-propyl- [ACD/Index Name]
1357086-93-1 [RN]
MFCD25958399

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 318.7±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 53.8±3.0 kJ/mol
Flash Point: 146.5±22.9 °C
Index of Refraction: 1.653
Molar Refractivity: 58.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 95.48
ACD/KOC (pH 5.5): 909.56
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 95.48
ACD/KOC (pH 7.4): 909.57
Polar Surface Area: 31 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 47.6±7.0 dyne/cm
Molar Volume: 158.4±7.0 cm3

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