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

ChemSpider 2D Image | (3R,4S)-3,4,6,7-Tetrachloro-3,7-dimethyl-1-octene | C10H16Cl4

(3R,4S)-3,4,6,7-Tetrachloro-3,7-dimethyl-1-octene

  • Molecular FormulaC10H16Cl4
  • Average mass278.046 Da
  • Monoisotopic mass276.000610 Da
  • ChemSpider ID27025496
  • defined stereocentres - 2 of 3 defined stereocentres


More details:



Featured data source



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

(3R,4S)-3,4,6,7-Tetrachlor-3,7-dimethyl-1-octen [German] [ACD/IUPAC Name]
(3R,4S)-3,4,6,7-Tetrachloro-3,7-dimethyl-1-octene [ACD/IUPAC Name]
(3R,4S)-3,4,6,7-Tétrachloro-3,7-diméthyl-1-octène [French] [ACD/IUPAC Name]
1-Octene, 3,4,6,7-tetrachloro-3,7-dimethyl-, (3R,4S)- [ACD/Index Name]
(3R,4S)-3,4,6,7-tetrachloro-3,7-dimethyloct-1-ene
1310070-64-4 [RN]
1-Octene, 3,4,6,7-tetrachloro-3,7-dimethyl-, (3R,4S)

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

Density: 1.2±0.1 g/cm3
Boiling Point: 338.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.9±3.0 kJ/mol
Flash Point: 152.9±25.3 °C
Index of Refraction: 1.485
Molar Refractivity: 67.3±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.12
ACD/LogD (pH 5.5): 5.25
ACD/BCF (pH 5.5): 5710.19
ACD/KOC (pH 5.5): 17006.02
ACD/LogD (pH 7.4): 5.25
ACD/BCF (pH 7.4): 5710.19
ACD/KOC (pH 7.4): 17006.02
Polar Surface Area: 0 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 31.7±3.0 dyne/cm
Molar Volume: 235.1±3.0 cm3

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