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

3-Iodo-5-(sulfanylmethyl)benzaldehyde

  • Molecular FormulaC8H7IOS
  • Average mass278.110 Da
  • Monoisotopic mass277.926208 Da
  • ChemSpider ID94273616

More details:

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

3-Iod-5-(sulfanylmethyl)benzaldehyd [German] [ACD/IUPAC Name]
3-Iodo-5-(sulfanylmethyl)benzaldehyde [ACD/IUPAC Name]
3-Iodo-5-(sulfanylméthyl)benzaldéhyde [French] [ACD/IUPAC Name]
Benzaldehyde, 3-iodo-5-(mercaptomethyl)- [ACD/Index Name]
2418642-31-4 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 359.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 171.4±27.9 °C
Index of Refraction: 1.691
Molar Refractivity: 58.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 3.08
ACD/BCF (pH 5.5): 129.49
ACD/KOC (pH 5.5): 1131.17
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 127.44
ACD/KOC (pH 7.4): 1113.23
Polar Surface Area: 56 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 153.5±3.0 cm3

Click to predict properties on the Chemicalize site


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