ChemSpider 2D Image | 3,3'-Disulfanediylbis(2-{[(1Z)-1-hydroxy-1-octen-1-yl]amino}-1-propene-1,1-diol) | C22H40N2O6S2

3,3'-Disulfanediylbis(2-{[(1Z)-1-hydroxy-1-octen-1-yl]amino}-1-propene-1,1-diol)

  • Molecular FormulaC22H40N2O6S2
  • Average mass492.693 Da
  • Monoisotopic mass492.232788 Da
  • ChemSpider ID95711802

More details:

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

1-Propene-1,1-diol, 3,3'-dithiobis[2-[[(1Z)-1-hydroxy-1-octen-1-yl]amino]- [ACD/Index Name]
3,3'-Disulfandiylbis(2-{[(1Z)-1-hydroxy-1-octen-1-yl]amino}-1-propen-1,1-diol) [German] [ACD/IUPAC Name]
3,3'-Disulfanediylbis(2-{[(1Z)-1-hydroxy-1-octen-1-yl]amino}-1-propene-1,1-diol) [ACD/IUPAC Name]
3,3'-Disulfanediylbis(2-{[(1Z)-1-hydroxy-1-octén-1-yl]amino}-1-propène-1,1-diol) [French] [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: 702.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 117.5±6.0 kJ/mol
Flash Point: 378.4±32.9 °C
Index of Refraction: 1.602
Molar Refractivity: 135.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 8
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 2
ACD/LogP: 8.47
ACD/LogD (pH 5.5): 5.41
ACD/BCF (pH 5.5): 7285.97
ACD/KOC (pH 5.5): 19077.29
ACD/LogD (pH 7.4): 5.49
ACD/BCF (pH 7.4): 8789.13
ACD/KOC (pH 7.4): 23013.10
Polar Surface Area: 196 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 395.6±3.0 cm3

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