ChemSpider 2D Image | 1-[(7E)-1,1,3,3-Tetraoxido-5,6-dihydro-4H-1,3-dithiocin-7-yl]pyrrolidine | C10H17NO4S2

1-[(7E)-1,1,3,3-Tetraoxido-5,6-dihydro-4H-1,3-dithiocin-7-yl]pyrrolidine

  • Molecular FormulaC10H17NO4S2
  • Average mass279.376 Da
  • Monoisotopic mass279.059906 Da
  • ChemSpider ID57446135

  • Double-bond stereo - Double-bond stereo

More details:

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

1-[(7E)-1,1,3,3-Tetraoxido-5,6-dihydro-4H-1,3-dithiocin-7-yl]pyrrolidin [German] [ACD/IUPAC Name]
1-[(7E)-1,1,3,3-Tetraoxido-5,6-dihydro-4H-1,3-dithiocin-7-yl]pyrrolidine [ACD/IUPAC Name]
1-[(7E)-1,1,3,3-Tétraoxydo-5,6-dihydro-4H-1,3-dithiocin-7-yl]pyrrolidine [French] [ACD/IUPAC Name]
Pyrrolidine, 1-[(7E)-5,6-dihydro-1,1,3,3-tetraoxido-4H-1,3-dithiocin-7-yl]- [ACD/Index Name]
89717-41-9 [RN]
Pyrrolidine, 1-(5,6-dihydro-1,1,3,3-tetraoxido-4H-1,3-dithiocin-7-yl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 574.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.1±3.0 kJ/mol
Flash Point: 301.3±30.1 °C
Index of Refraction: 1.569
Molar Refractivity: 65.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.32
ACD/LogD (pH 5.5): -0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 23.36
ACD/LogD (pH 7.4): -0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 23.57
Polar Surface Area: 88 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 53.8±3.0 dyne/cm
Molar Volume: 199.8±3.0 cm3

Click to predict properties on the Chemicalize site


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