Found 25 results

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

ChemSpider 2D Image | (1R,2S,3r,4R,5S,6s)-1,2,3,4,5,6-Hexachlorocyclohexane | C6H6Cl6

(1R,2S,3r,4R,5S,6s)-1,2,3,4,5,6-Hexachlorocyclohexane

  • Molecular FormulaC6H6Cl6
  • Average mass290.830 Da
  • Monoisotopic mass287.860077 Da
  • ChemSpider ID21170544
  • defined stereocentres - 1 of 6 defined stereocentres


More details:






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

(1R,2S,3r,4R,5S,6s)-1,2,3,4,5,6-Hexachlorcyclohexan [German] [ACD/IUPAC Name]
(1R,2S,3r,4R,5S,6s)-1,2,3,4,5,6-Hexachlorocyclohexane [ACD/IUPAC Name]
(1R,2S,3r,4R,5S,6s)-1,2,3,4,5,6-Hexachlorocyclohexane [French] [ACD/IUPAC Name]
Cyclohexane, 1,2,3,4,5,6-hexachloro-, (1α,2α,3α,4β,5α,6β)- [ACD/Index Name]
α-1,2,3,4,5,6-Hexachlorocyclohexane
α-BHC

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

48493_SUPELCO [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 288.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.6±3.0 kJ/mol
Flash Point: 157.5±23.9 °C
Index of Refraction: 1.533
Molar Refractivity: 56.6±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.99
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 472.80
ACD/KOC (pH 5.5): 2858.51
ACD/LogD (pH 7.4): 3.82
ACD/BCF (pH 7.4): 472.80
ACD/KOC (pH 7.4): 2858.51
Polar Surface Area: 0 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 41.0±5.0 dyne/cm
Molar Volume: 182.6±5.0 cm3

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