Found 37 results

Search term: MF = 'C_{13}H_{9}IN_{2}S'
ChemSpider 2D Image | 3-Iodo-5-(phenylsulfanyl)-1H-pyrrolo[2,3-b]pyridine | C13H9IN2S

3-Iodo-5-(phenylsulfanyl)-1H-pyrrolo[2,3-b]pyridine

  • Molecular FormulaC13H9IN2S
  • Average mass352.193 Da
  • Monoisotopic mass351.953094 Da
  • ChemSpider ID28559755

More details:

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

1H-Pyrrolo[2,3-b]pyridine, 3-iodo-5-(phenylthio)- [ACD/Index Name]
3-Iod-5-(phenylsulfanyl)-1H-pyrrolo[2,3-b]pyridin [German] [ACD/IUPAC Name]
3-Iodo-5-(phenylsulfanyl)-1H-pyrrolo[2,3-b]pyridine [ACD/IUPAC Name]
3-Iodo-5-(phénylsulfanyl)-1H-pyrrolo[2,3-b]pyridine [French] [ACD/IUPAC Name]
3-Iodo-5-(phenylthio)-1H-pyrrolo[2,3-b]pyridine
923583-56-6 [RN]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 503.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 258.4±28.7 °C
Index of Refraction: 1.804
Molar Refractivity: 81.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.46
ACD/LogD (pH 5.5): 4.61
ACD/BCF (pH 5.5): 1873.30
ACD/KOC (pH 5.5): 7655.79
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1875.31
ACD/KOC (pH 7.4): 7664.02
Polar Surface Area: 54 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 77.8±5.0 dyne/cm
Molar Volume: 190.4±5.0 cm3

Click to predict properties on the Chemicalize site


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