ChemSpider 2D Image | 2-Amino-6-bromo-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile | C7H4BrN5O

2-Amino-6-bromo-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

  • Molecular FormulaC7H4BrN5O
  • Average mass254.044 Da
  • Monoisotopic mass252.959915 Da
  • ChemSpider ID24631292

More details:

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

2-Amino-6-brom-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-5-carbonitril [German] [ACD/IUPAC Name]
2-Amino-6-bromo-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile [ACD/IUPAC Name]
2-Amino-6-bromo-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile [French] [ACD/IUPAC Name]
3H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile, 2-amino-6-bromo-4,7-dihydro-4-oxo- [ACD/Index Name]
JU2

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

Density: 2.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.950
Molar Refractivity: 51.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.44
ACD/LogD (pH 5.5): 0.69
ACD/BCF (pH 5.5): 1.97
ACD/KOC (pH 5.5): 56.54
ACD/LogD (pH 7.4): 0.69
ACD/BCF (pH 7.4): 1.95
ACD/KOC (pH 7.4): 55.95
Polar Surface Area: 107 Å2
Polarizability: 20.3±0.5 10-24cm3
Surface Tension: 104.0±7.0 dyne/cm
Molar Volume: 105.8±7.0 cm3

Click to predict properties on the Chemicalize site


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