ChemSpider 2D Image | 7-Amino-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one | C5H5N5OS

7-Amino-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

  • Molecular FormulaC5H5N5OS
  • Average mass183.191 Da
  • Monoisotopic mass183.021484 Da
  • ChemSpider ID21791464

More details:

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

4H-[1,3,4]Thiadiazolo[2,3-c][1,2,4]triazin-4-one, 7-amino-3-methyl- [ACD/Index Name]
7-Amino-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-on [German] [ACD/IUPAC Name]
7-Amino-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one [ACD/IUPAC Name]
7-Amino-3-méthyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one [French] [ACD/IUPAC Name]
24272-84-2 [RN]
MFCD11868911

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

Density: 2.1±0.1 g/cm3
Boiling Point: 313.0±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 143.1±23.2 °C
Index of Refraction: 1.990
Molar Refractivity: 44.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -2.64
ACD/LogD (pH 5.5): -1.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.26
ACD/LogD (pH 7.4): -1.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.26
Polar Surface Area: 109 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 108.6±7.0 dyne/cm
Molar Volume: 88.6±7.0 cm3

Click to predict properties on the Chemicalize site


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