ChemSpider 2D Image | 7-Amino-6-(chloroacetyl)-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-5(1H)-one | C8H8ClN5O2

7-Amino-6-(chloroacetyl)-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-5(1H)-one

  • Molecular FormulaC8H8ClN5O2
  • Average mass241.634 Da
  • Monoisotopic mass241.036652 Da
  • ChemSpider ID27455720

More details:

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

[1,2,4]Triazolo[1,5-a]pyrimidin-5(4H)-one, 7-amino-6-(2-chloroacetyl)-2-methyl- [ACD/Index Name]
7-Amino-6-(2-chloroacétyl)-2-méthyl[1,2,4]triazolo[1,5-a]pyrimidin-5(1H)-one [French] [ACD/IUPAC Name]
7-Amino-6-(chloracetyl)-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-5(1H)-on [German] [ACD/IUPAC Name]
7-Amino-6-(chloroacetyl)-2-methyl[1,2,4]triazolo[1,5-a]pyrimidin-5(1H)-one [ACD/IUPAC Name]
[1,2,4]triazolo[1,5-a]pyrimidin-5(4H)-one, 7-amino-6-(chloroacetyl)-2-methyl-

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.805
Molar Refractivity: 55.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.72
ACD/LogD (pH 5.5): -0.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.70
ACD/LogD (pH 7.4): -0.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.44
Polar Surface Area: 103 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 80.6±7.0 dyne/cm
Molar Volume: 129.1±7.0 cm3

Click to predict properties on the Chemicalize site


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