ChemSpider 2D Image | S-[2,6-Diformyl-4-(2-methyl-2-propanyl)phenyl] dimethylcarbamothioate | C15H19NO3S

S-[2,6-Diformyl-4-(2-methyl-2-propanyl)phenyl] dimethylcarbamothioate

  • Molecular FormulaC15H19NO3S
  • Average mass293.381 Da
  • Monoisotopic mass293.108551 Da
  • ChemSpider ID21130480

More details:

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

Carbamothioic acid, N,N-dimethyl-, S-[4-(1,1-dimethylethyl)-2,6-diformylphenyl] ester [ACD/Index Name]
Diméthylcarbamothioate de S-[2,6-diformyl-4-(2-méthyl-2-propanyl)phényle] [French] [ACD/IUPAC Name]
S-[2,6-Diformyl-4-(2-methyl-2-propanyl)phenyl] dimethylcarbamothioate [ACD/IUPAC Name]
S-[2,6-Diformyl-4-(2-methyl-2-propanyl)phenyl]-dimethylcarbamothioat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 403.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 197.9±31.5 °C
Index of Refraction: 1.566
Molar Refractivity: 81.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.23
ACD/LogD (pH 5.5): 2.75
ACD/BCF (pH 5.5): 72.50
ACD/KOC (pH 5.5): 746.83
ACD/LogD (pH 7.4): 2.75
ACD/BCF (pH 7.4): 72.50
ACD/KOC (pH 7.4): 746.83
Polar Surface Area: 80 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 48.7±5.0 dyne/cm
Molar Volume: 248.7±5.0 cm3

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