ChemSpider 2D Image | 2-Amino-1,2-dihydro-6H-purine-6-thione | C5H5N5S

2-Amino-1,2-dihydro-6H-purine-6-thione

  • Molecular FormulaC5H5N5S
  • Average mass167.192 Da
  • Monoisotopic mass167.026566 Da
  • ChemSpider ID28536984

More details:

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

2-Amino-1,2-dihydro-6H-purin-6-thion [German] [ACD/IUPAC Name]
2-Amino-1,2-dihydro-6H-purine-6-thione [ACD/IUPAC Name]
2-Amino-1,2-dihydro-6H-purine-6-thione [French] [ACD/IUPAC Name]
2-amino-2,6-dihydro-1H-purine-6-thione
6H-Purine-6-thione, 2-amino-1,2-dihydro- [ACD/Index Name]
2-amino-1,2-dihydropurine-6-thione
2-Amino-1H-purine-6(7H)-thione
2-Amino-9H-purine-6-thiol [ACD/IUPAC Name]
905807-94-5 [RN]
MFCD00233553 [MDL number]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 289.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.9±3.0 kJ/mol
Flash Point: 128.9±30.1 °C
Index of Refraction: 2.071
Molar Refractivity: 41.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -2.02
ACD/LogD (pH 5.5): -1.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.86
ACD/LogD (pH 7.4): -1.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.21
Polar Surface Area: 107 Å2
Polarizability: 16.6±0.5 10-24cm3
Surface Tension: 98.6±7.0 dyne/cm
Molar Volume: 80.2±7.0 cm3

Click to predict properties on the Chemicalize site


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