Found 80 results

Search term: MF = 'C_{8}H_{6}INS'
ChemSpider 2D Image | 2-Iodo-4-(methylsulfanyl)benzonitrile | C8H6INS

2-Iodo-4-(methylsulfanyl)benzonitrile

  • Molecular FormulaC8H6INS
  • Average mass275.109 Da
  • Monoisotopic mass274.926544 Da
  • ChemSpider ID34209710

More details:

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

2-Iod-4-(methylsulfanyl)benzonitril [German] [ACD/IUPAC Name]
2-Iodo-4-(methylsulfanyl)benzonitrile [ACD/IUPAC Name]
2-Iodo-4-(méthylsulfanyl)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-iodo-4-(methylthio)- [ACD/Index Name]
54558-83-7 [RN]
MFCD22489435

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

Density: 1.8±0.1 g/cm3
Boiling Point: 351.4±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.6±3.0 kJ/mol
Flash Point: 166.3±26.5 °C
Index of Refraction: 1.683
Molar Refractivity: 56.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 235.25
ACD/KOC (pH 5.5): 1734.40
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 235.25
ACD/KOC (pH 7.4): 1734.40
Polar Surface Area: 49 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 60.1±5.0 dyne/cm
Molar Volume: 150.0±5.0 cm3

Click to predict properties on the Chemicalize site


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