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Search term: CFBSLRFEUSJDFX (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 3-Iodo-5-(methylsulfanyl)benzaldehyde | C8H7IOS

3-Iodo-5-(methylsulfanyl)benzaldehyde

  • Molecular FormulaC8H7IOS
  • Average mass278.110 Da
  • Monoisotopic mass277.926208 Da
  • ChemSpider ID62025565

More details:






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

3-Iod-5-(methylsulfanyl)benzaldehyd [German] [ACD/IUPAC Name]
3-Iodo-5-(methylsulfanyl)benzaldehyde [ACD/IUPAC Name]
3-Iodo-5-(méthylsulfanyl)benzaldéhyde [French] [ACD/IUPAC Name]
Benzaldehyde, 3-iodo-5-(methylthio)- [ACD/Index Name]
1289015-21-9 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point: 329.4±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.2±3.0 kJ/mol
Flash Point: 153.0±26.5 °C
Index of Refraction: 1.670
Molar Refractivity: 57.3±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 202.26
ACD/KOC (pH 5.5): 1556.60
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 202.26
ACD/KOC (pH 7.4): 1556.60
Polar Surface Area: 42 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 54.7±5.0 dyne/cm
Molar Volume: 153.4±5.0 cm3

Click to predict properties on the Chemicalize site






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