ChemSpider 2D Image | 2,3-Bis[(2,2-dihydroxyvinyl)sulfanyl]-1,4-naphthoquinone | C14H10O6S2

2,3-Bis[(2,2-dihydroxyvinyl)sulfanyl]-1,4-naphthoquinone

  • Molecular FormulaC14H10O6S2
  • Average mass338.356 Da
  • Monoisotopic mass337.991882 Da
  • ChemSpider ID95757349

More details:

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

1,4-Naphthalenedione, 2,3-bis[(2,2-dihydroxyethenyl)thio]- [ACD/Index Name]
2,3-Bis[(2,2-dihydroxyvinyl)sulfanyl]-1,4-naphthochinon [German] [ACD/IUPAC Name]
2,3-Bis[(2,2-dihydroxyvinyl)sulfanyl]-1,4-naphthoquinone [ACD/IUPAC Name]
2,3-Bis[(2,2-dihydroxyvinyl)sulfanyl]-1,4-naphtoquinone [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 529.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 273.8±30.1 °C
Index of Refraction: 1.804
Molar Refractivity: 83.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.55
ACD/LogD (pH 5.5): 0.58
ACD/BCF (pH 5.5): 1.61
ACD/KOC (pH 5.5): 49.01
ACD/LogD (pH 7.4): 0.52
ACD/BCF (pH 7.4): 1.42
ACD/KOC (pH 7.4): 43.26
Polar Surface Area: 166 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 108.6±5.0 dyne/cm
Molar Volume: 193.3±5.0 cm3

Click to predict properties on the Chemicalize site


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