ChemSpider 2D Image | 1H-Indole-3-carbodithioic acid | C9H7NS2

1H-Indole-3-carbodithioic acid

  • Molecular FormulaC9H7NS2
  • Average mass193.289 Da
  • Monoisotopic mass193.001984 Da
  • ChemSpider ID57428768

More details:






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

1H-Indol-3-carbodithiosäure [German] [ACD/IUPAC Name]
1H-Indole-3-carbodithioic acid [ACD/Index Name] [ACD/IUPAC Name]
Acide 1H-indole-3-carbodithioïque [French] [ACD/IUPAC Name]
58244-16-9 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 371.8±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.5±3.0 kJ/mol
Flash Point: 178.7±25.7 °C
Index of Refraction: 1.795
Molar Refractivity: 59.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.64
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.89
ACD/LogD (pH 7.4): -0.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 75.7±3.0 dyne/cm
Molar Volume: 138.8±3.0 cm3

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