ChemSpider 2D Image | (1R,2S,4S)-1,2-Dibromo-4-[(1R)-1,2-dibromoethyl]cyclohexane | C8H12Br4

(1R,2S,4S)-1,2-Dibromo-4-[(1R)-1,2-dibromoethyl]cyclohexane

  • Molecular FormulaC8H12Br4
  • Average mass427.797 Da
  • Monoisotopic mass423.767212 Da
  • ChemSpider ID34984961

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1R,2S,4S)-1,2-Dibrom-4-[(1R)-1,2-dibromethyl]cyclohexan [German] [ACD/IUPAC Name]
(1R,2S,4S)-1,2-Dibromo-4-[(1R)-1,2-dibromoethyl]cyclohexane [ACD/IUPAC Name]
(1R,2S,4S)-1,2-Dibromo-4-[(1R)-1,2-dibromoéthyl]cyclohexane [French] [ACD/IUPAC Name]
Cyclohexane, 1,2-dibromo-4-[(1R)-1,2-dibromoethyl]-, (1R,2S,4S)- [ACD/Index Name]
1-(1,2-Dibromoethyl)-3,4-dibromocyclohexane
222-036-8 [EINECS]
3322-93-8 [RN]
UNII-502D5Q149T

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

Density: 2.2±0.1 g/cm3
Boiling Point: 371.2±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.4±3.0 kJ/mol
Flash Point: 173.3±17.1 °C
Index of Refraction: 1.605
Molar Refractivity: 67.9±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 4.61
ACD/BCF (pH 5.5): 1868.42
ACD/KOC (pH 5.5): 7643.95
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1868.42
ACD/KOC (pH 7.4): 7643.95
Polar Surface Area: 0 Å2
Polarizability: 26.9±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 197.1±3.0 cm3

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