ChemSpider 2D Image | 4-Amino-2,7(1H,3H)-pteridinedione | C6H5N5O2

4-Amino-2,7(1H,3H)-pteridinedione

  • Molecular FormulaC6H5N5O2
  • Average mass179.136 Da
  • Monoisotopic mass179.044327 Da
  • ChemSpider ID23979776

More details:

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

2,7(1H,3H)-Pteridinedione, 4-amino- [ACD/Index Name]
4-Amino-2,7(1H,3H)-pteridindion [German] [ACD/IUPAC Name]
4-Amino-2,7(1H,3H)-pteridinedione [ACD/IUPAC Name]
4-Amino-2,7(1H,3H)-ptéridinedione [French] [ACD/IUPAC Name]
2,7(1H,8H)-Pteridinedione, 4-amino- (7CI,9CI)
22005-67-0 [RN]
4-Aminopteridine-2,7(1H,3H)-dione
4-AMINOPTERIDINE-2,7(1H,8H)-DIONE
4-Aminopteridine-2,7(3H,8H)-dione

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

Density: 2.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.992
Molar Refractivity: 40.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -2.89
ACD/LogD (pH 5.5): -2.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.90
ACD/LogD (pH 7.4): -2.46
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 122.7±7.0 dyne/cm
Molar Volume: 82.3±7.0 cm3

Click to predict properties on the Chemicalize site


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