ChemSpider 2D Image | 4-Amino-1,2,5-thiadiazole-3-carbonitrile | C3H2N4S

4-Amino-1,2,5-thiadiazole-3-carbonitrile

  • Molecular FormulaC3H2N4S
  • Average mass126.140 Da
  • Monoisotopic mass126.000015 Da
  • ChemSpider ID62126923

More details:

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

1,2,5-Thiadiazole-3-carbonitrile, 4-amino- [ACD/Index Name]
4-Amino-1,2,5-thiadiazol-3-carbonitril [German] [ACD/IUPAC Name]
4-Amino-1,2,5-thiadiazole-3-carbonitrile [ACD/IUPAC Name]
4-Amino-1,2,5-thiadiazole-3-carbonitrile [French] [ACD/IUPAC Name]
2090508-34-0 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 344.4±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.8±3.0 kJ/mol
Flash Point: 162.1±23.7 °C
Index of Refraction: 1.645
Molar Refractivity: 28.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.60
ACD/LogD (pH 5.5): 0.60
ACD/BCF (pH 5.5): 1.68
ACD/KOC (pH 5.5): 50.56
ACD/LogD (pH 7.4): 0.60
ACD/BCF (pH 7.4): 1.68
ACD/KOC (pH 7.4): 50.56
Polar Surface Area: 104 Å2
Polarizability: 11.4±0.5 10-24cm3
Surface Tension: 111.6±5.0 dyne/cm
Molar Volume: 79.1±5.0 cm3

Click to predict properties on the Chemicalize site


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