ChemSpider 2D Image | 3,5,7-Trimethyl-2H-pyrimido[4,5-e][1,2,4]thiadiazine-6,8(5H,7H)-dione 1,1-dioxide | C8H10N4O4S

3,5,7-Trimethyl-2H-pyrimido[4,5-e][1,2,4]thiadiazine-6,8(5H,7H)-dione 1,1-dioxide

  • Molecular FormulaC8H10N4O4S
  • Average mass258.254 Da
  • Monoisotopic mass258.042267 Da
  • ChemSpider ID32777649

More details:

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

1,1-Dioxyde de 3,5,7-triméthyl-2H-pyrimido[4,5-e][1,2,4]thiadiazine-6,8(5H,7H)-dione [French] [ACD/IUPAC Name]
2H-Pyrimido[4,5-e]-1,2,4-thiadiazine-6,8(5H,7H)-dione, 3,5,7-trimethyl-, 1,1-dioxide [ACD/Index Name]
3,5,7-Trimethyl-2H-pyrimido[4,5-e][1,2,4]thiadiazin-6,8(5H,7H)-dion-1,1-dioxid [German] [ACD/IUPAC Name]
3,5,7-Trimethyl-2H-pyrimido[4,5-e][1,2,4]thiadiazine-6,8(5H,7H)-dione 1,1-dioxide [ACD/IUPAC Name]
25622-15-5 [RN]
2H-PYRIMIDO[4,5-E]-1,2,4-THIADIAZINE-6,8(5H,7H)-DIONE,3,5,7-TRIMETHYL-, 1,1-DIOXIDE
3,5,7-Trimethyl-1λ6-pyrimido[4,5-e][1,2,4]thiadiazine-1,1,6,8(4H,5H,7H)-tetrone

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

Density: 1.7±0.1 g/cm3
Boiling Point: 387.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.7±3.0 kJ/mol
Flash Point: 188.2±30.7 °C
Index of Refraction: 1.735
Molar Refractivity: 59.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.98
ACD/LogD (pH 5.5): -3.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 108 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 72.7±7.0 dyne/cm
Molar Volume: 147.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement