Found 2 results

Search term: XMGWHQMRXFAHNZ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-Iodo-3-(methylsulfonyl)(3-~2~H_1_)-1-propene | C4H6DIO2S

2-Iodo-3-(methylsulfonyl)(3-2H1)-1-propene

  • Molecular FormulaC4H6DIO2S
  • Average mass247.073 Da
  • Monoisotopic mass246.927414 Da
  • ChemSpider ID8975785

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Propene-3-d, 2-iodo-3-(methylsulfonyl)- [ACD/Index Name]
2-Iod-3-(methylsulfonyl)(3-2H1)-1-propen [German] [ACD/IUPAC Name]
2-Iodo-3-(methylsulfonyl)(3-2H1)-1-propene [ACD/IUPAC Name]
2-Iodo-3-(méthylsulfonyl)(3-2H1)-1-propène [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 322.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.2±3.0 kJ/mol
Flash Point: 148.7±25.9 °C
Index of Refraction: 1.561
Molar Refractivity: 41.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.60
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 4.73
ACD/KOC (pH 5.5): 105.86
ACD/LogD (pH 7.4): 1.19
ACD/BCF (pH 7.4): 4.73
ACD/KOC (pH 7.4): 105.86
Polar Surface Area: 43 Å2
Polarizability: 16.6±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 129.3±3.0 cm3

Click to predict properties on the Chemicalize site


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