ChemSpider 2D Image | N,N'-1,3-Propanediylbis(N-methyl-2-phenylethanethioamide) | C21H26N2S2

N,N'-1,3-Propanediylbis(N-methyl-2-phenylethanethioamide)

  • Molecular FormulaC21H26N2S2
  • Average mass370.574 Da
  • Monoisotopic mass370.153748 Da
  • ChemSpider ID57520313

More details:






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

Benzeneethanethioamide, N,N'-1,3-propanediylbis[N'-methyl- [ACD/Index Name]
N,N'-1,3-Propandiylbis(N-methyl-2-phenylethanthioamid) [German] [ACD/IUPAC Name]
N,N'-1,3-Propanediylbis(N-methyl-2-phenylethanethioamide) [ACD/IUPAC Name]
N,N'-1,3-Propanediylbis(N-méthyl-2-phényléthanethioamide) [French] [ACD/IUPAC Name]
63820-33-7 [RN]
N,N'-(Propane-1,3-diyl)bis[N-methyl(phenyl)ethanethioamide]
N-METHYL-N-[3-(N-METHYL-2-PHENYLETHANETHIOAMIDO)PROPYL]-2-PHENYLETHANETHIOAMIDE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 509.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.0±3.0 kJ/mol
Flash Point: 262.1±32.9 °C
Index of Refraction: 1.629
Molar Refractivity: 114.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.54
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1351.78
ACD/KOC (pH 5.5): 6062.73
ACD/LogD (pH 7.4): 4.42
ACD/BCF (pH 7.4): 1352.14
ACD/KOC (pH 7.4): 6064.33
Polar Surface Area: 71 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 54.9±3.0 dyne/cm
Molar Volume: 323.0±3.0 cm3

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