Found 396 results

Search term: MF = 'C_{6}H_{12}N_{4}OS'
ChemSpider 2D Image | 3-(Butylsulfinyl)-1H-1,2,4-triazol-5-amine | C6H12N4OS

3-(Butylsulfinyl)-1H-1,2,4-triazol-5-amine

  • Molecular FormulaC6H12N4OS
  • Average mass188.251 Da
  • Monoisotopic mass188.073181 Da
  • ChemSpider ID67965397

More details:

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

1H-1,2,4-Triazol-5-amine, 3-(butylsulfinyl)- [ACD/Index Name]
3-(Butylsulfinyl)-1H-1,2,4-triazol-5-amin [German] [ACD/IUPAC Name]
3-(Butylsulfinyl)-1H-1,2,4-triazol-5-amine [ACD/IUPAC Name]
3-(Butylsulfinyl)-1H-1,2,4-triazol-5-amine [French] [ACD/IUPAC Name]
2215441-67-9 [RN]
MFCD31619039

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

Density: 1.4±0.1 g/cm3
Boiling Point: 459.0±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.9±3.0 kJ/mol
Flash Point: 231.4±24.0 °C
Index of Refraction: 1.617
Molar Refractivity: 47.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.56
ACD/LogD (pH 5.5): -0.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.09
ACD/LogD (pH 7.4): -0.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.96
Polar Surface Area: 104 Å2
Polarizability: 18.7±0.5 10-24cm3
Surface Tension: 91.0±5.0 dyne/cm
Molar Volume: 135.1±5.0 cm3

Click to predict properties on the Chemicalize site


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