ChemSpider 2D Image | (1S,3R)-1-Bromo-3-chlorocyclohexane | C6H10BrCl

(1S,3R)-1-Bromo-3-chlorocyclohexane

  • Molecular FormulaC6H10BrCl
  • Average mass197.501 Da
  • Monoisotopic mass195.965439 Da
  • ChemSpider ID61314872

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,3R)-1-Brom-3-chlorcyclohexan [German] [ACD/IUPAC Name]
(1S,3R)-1-Bromo-3-chlorocyclohexane [ACD/IUPAC Name]
(1S,3R)-1-Bromo-3-chlorocyclohexane [French] [ACD/IUPAC Name]
Cyclohexane, 1-bromo-3-chloro-, (1S,3R)- [ACD/Index Name]
32719-05-4 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 219.9±33.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.8±3.0 kJ/mol
Flash Point: 99.6±15.5 °C
Index of Refraction: 1.507
Molar Refractivity: 40.3±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.94
ACD/LogD (pH 5.5): 3.09
ACD/BCF (pH 5.5): 130.14
ACD/KOC (pH 5.5): 1135.30
ACD/LogD (pH 7.4): 3.09
ACD/BCF (pH 7.4): 130.14
ACD/KOC (pH 7.4): 1135.30
Polar Surface Area: 0 Å2
Polarizability: 16.0±0.5 10-24cm3
Surface Tension: 34.7±5.0 dyne/cm
Molar Volume: 135.3±5.0 cm3

Click to predict properties on the Chemicalize site


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