ChemSpider 2D Image | 2-Amino-7-(methylsulfanyl)-4(1H)-pteridinone | C7H7N5OS

2-Amino-7-(methylsulfanyl)-4(1H)-pteridinone

  • Molecular FormulaC7H7N5OS
  • Average mass209.228 Da
  • Monoisotopic mass209.037125 Da
  • ChemSpider ID28673530

More details:

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

2-Amino-7-(methylsulfanyl)-4(1H)-pteridinon [German] [ACD/IUPAC Name]
2-Amino-7-(methylsulfanyl)-4(1H)-pteridinone [ACD/IUPAC Name]
2-Amino-7-(méthylsulfanyl)-4(1H)-ptéridinone [French] [ACD/IUPAC Name]
4(1H)-Pteridinone, 2-amino-7-(methylthio)- [ACD/Index Name]
113193-94-5 [RN]
2-Amino-7-(methylsulfanyl)pteridin-4(1H)-one
2-Amino-7-(methylthio)pteridin-4(1H)-one

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

Density: 1.8±0.1 g/cm3
Boiling Point: 461.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.3±3.0 kJ/mol
Flash Point: 233.1±31.5 °C
Index of Refraction: 1.874
Molar Refractivity: 52.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.19
ACD/LogD (pH 5.5): 0.42
ACD/BCF (pH 5.5): 1.23
ACD/KOC (pH 5.5): 40.24
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.23
ACD/KOC (pH 7.4): 40.24
Polar Surface Area: 119 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 85.3±7.0 dyne/cm
Molar Volume: 114.8±7.0 cm3

Click to predict properties on the Chemicalize site


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