Found 26 results

Search term: MF = 'C_{4}H_{6}N_{4}OS_{2}'
ChemSpider 2D Image | 3-(Methylsulfanyl)-6-(methylsulfinyl)-1,2,4,5-tetrazine | C4H6N4OS2

3-(Methylsulfanyl)-6-(methylsulfinyl)-1,2,4,5-tetrazine

  • Molecular FormulaC4H6N4OS2
  • Average mass190.247 Da
  • Monoisotopic mass189.998306 Da
  • ChemSpider ID21514188

More details:

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

1,2,4,5-Tetrazine, 3-(methylsulfinyl)-6-(methylthio)- [ACD/Index Name]
3-(Methylsulfanyl)-6-(methylsulfinyl)-1,2,4,5-tetrazin [German] [ACD/IUPAC Name]
3-(Methylsulfanyl)-6-(methylsulfinyl)-1,2,4,5-tetrazine [ACD/IUPAC Name]
3-(Méthylsulfanyl)-6-(méthylsulfinyl)-1,2,4,5-tétrazine [French] [ACD/IUPAC Name]
3-Methanesulfinyl-6-methylsulfanyl-; [1,2,4,5]tetrazine
[1,2,4,5]tetrazine
3-Methanesulfinyl-6-methylsulfanyl-
3-Methanesulfinyl-6-methylsulfanyl-[1,2,4,5]tetrazine
874278-37-2 [RN]
MFCD09032146 [MDL number]

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

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

Density: 1.6±0.1 g/cm3
Boiling Point: 452.3±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 68.4±3.0 kJ/mol
Flash Point: 227.4±24.0 °C
Index of Refraction: 1.665
Molar Refractivity: 44.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.59
ACD/LogD (pH 5.5): -1.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.01
ACD/LogD (pH 7.4): -1.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.01
Polar Surface Area: 113 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 116.2±5.0 dyne/cm
Molar Volume: 118.6±5.0 cm3

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