ChemSpider 2D Image | [(1S,4R)-1,4,5,6,7,7-Hexachloro-3-methylenebicyclo[2.2.1]hept-5-en-2-yl]methyl hydrogen sulfate | C9H6Cl6O4S

[(1S,4R)-1,4,5,6,7,7-Hexachloro-3-methylenebicyclo[2.2.1]hept-5-en-2-yl]methyl hydrogen sulfate

  • Molecular FormulaC9H6Cl6O4S
  • Average mass422.924 Da
  • Monoisotopic mass419.811798 Da
  • ChemSpider ID71048377

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

[(1S,4R)-1,4,5,6,7,7-Hexachlor-3-methylenbicyclo[2.2.1]hept-5-en-2-yl]methylhydrogensulfat [German] [ACD/IUPAC Name]
[(1S,4R)-1,4,5,6,7,7-Hexachloro-3-methylenebicyclo[2.2.1]hept-5-en-2-yl]methyl hydrogen sulfate [ACD/IUPAC Name]
Bicyclo[2.2.1]hept-5-ene-2-methanol, 1,4,5,6,7,7-hexachloro-3-methylene-, hydrogen sulfate, (1S,4R)- [ACD/Index Name]
Hydrogénosulfate de [(1S,4R)-1,4,5,6,7,7-hexachloro-3-méthylènebicyclo[2.2.1]hept-5-én-2-yl]méthyle [French] [ACD/IUPAC Name]
Endosulfan hemisulfate

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.636
Molar Refractivity: 79.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.71
ACD/LogD (pH 5.5): 0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 72 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 66.2±5.0 dyne/cm
Molar Volume: 222.4±5.0 cm3

Click to predict properties on the Chemicalize site


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