ChemSpider 2D Image | 3,4-Disulfanylbenzaldehyde | C7H6OS2

3,4-Disulfanylbenzaldehyde

  • Molecular FormulaC7H6OS2
  • Average mass170.252 Da
  • Monoisotopic mass169.986008 Da
  • ChemSpider ID62795346

More details:

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

3,4-Disulfanylbenzaldehyd [German] [ACD/IUPAC Name]
3,4-Disulfanylbenzaldehyde [ACD/IUPAC Name]
3,4-Disulfanylbenzaldéhyde [French] [ACD/IUPAC Name]
Benzaldehyde, 3,4-dimercapto- [ACD/Index Name]
85403-62-9 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 328.2±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.1±3.0 kJ/mol
Flash Point: 152.3±25.1 °C
Index of Refraction: 1.710
Molar Refractivity: 49.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 1.59
ACD/BCF (pH 5.5): 6.03
ACD/KOC (pH 5.5): 73.60
ACD/LogD (pH 7.4): -0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.43
Polar Surface Area: 95 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 126.3±3.0 cm3

Click to predict properties on the Chemicalize site


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