ChemSpider 2D Image | 3-(1-Methyl-1H-pyrazol-4-yl)-1,2,4-thiadiazol-5-amine | C6H7N5S

3-(1-Methyl-1H-pyrazol-4-yl)-1,2,4-thiadiazol-5-amine

  • Molecular FormulaC6H7N5S
  • Average mass181.218 Da
  • Monoisotopic mass181.042221 Da
  • ChemSpider ID28109131

More details:

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

1,2,4-Thiadiazol-5-amine, 3-(1-methyl-1H-pyrazol-4-yl)- [ACD/Index Name]
3-(1-Methyl-1H-pyrazol-4-yl)-1,2,4-thiadiazol-5-amin [German] [ACD/IUPAC Name]
3-(1-Methyl-1H-pyrazol-4-yl)-1,2,4-thiadiazol-5-amine [ACD/IUPAC Name]
3-(1-Méthyl-1H-pyrazol-4-yl)-1,2,4-thiadiazol-5-amine [French] [ACD/IUPAC Name]
1153983-46-0 [RN]
MFCD05865108 [MDL number]
MFCD12137289
NS-01589

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

Density: 1.7±0.1 g/cm3
Boiling Point: 412.3±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.5±3.0 kJ/mol
Flash Point: 203.1±29.3 °C
Index of Refraction: 1.844
Molar Refractivity: 47.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.40
ACD/LogD (pH 5.5): 0.53
ACD/BCF (pH 5.5): 1.50
ACD/KOC (pH 5.5): 46.51
ACD/LogD (pH 7.4): 0.54
ACD/BCF (pH 7.4): 1.50
ACD/KOC (pH 7.4): 46.54
Polar Surface Area: 98 Å2
Polarizability: 18.9±0.5 10-24cm3
Surface Tension: 77.8±7.0 dyne/cm
Molar Volume: 107.4±7.0 cm3

Click to predict properties on the Chemicalize site


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