ChemSpider 2D Image | 2-Chloro-3-[trans-4-(4-chlorophenyl)cyclohexyl]-1,4-naphthoquinone | C22H18Cl2O2

2-Chloro-3-[trans-4-(4-chlorophenyl)cyclohexyl]-1,4-naphthoquinone

  • Molecular FormulaC22H18Cl2O2
  • Average mass385.283 Da
  • Monoisotopic mass384.068390 Da
  • ChemSpider ID23349906

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1,4-Naphthalenedione, 2-chloro-3-[trans-4-(4-chlorophenyl)cyclohexyl]- [ACD/Index Name]
153977-22-1 [RN]
2-Chlor-3-[trans-4-(4-chlorphenyl)cyclohexyl]-1,4-naphthochinon [German] [ACD/IUPAC Name]
2-Chloro-3-[trans-4-(4-chlorophenyl)cyclohexyl]-1,4-naphthoquinone [ACD/IUPAC Name]
2-Chloro-3-[trans-4-(4-chlorophényl)cyclohexyl]-1,4-naphtoquinone [French] [ACD/IUPAC Name]
trans-2-Chloro-3-[4-(4-chlorophenyl)cyclohexyl]-1,4-naphthalenedione
trans-2-Chloro-3-[4-(4-chlorophenyl)cyclohexyl]-1,4-naphthalenequinone
1,4-Naphthalenedione, 2-chloro-3-[trans-4-(4-chlorophenyl)cyclohexyl]
trans-2-chloro-3-(4-(4-chlorophenyl)cyclohexyl)-1,4-naphthalenedione

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

Density: 1.3±0.1 g/cm3
Boiling Point: 517.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 216.1±30.7 °C
Index of Refraction: 1.640
Molar Refractivity: 103.0±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.60
ACD/LogD (pH 5.5): 6.04
ACD/BCF (pH 5.5): 22878.47
ACD/KOC (pH 5.5): 45926.53
ACD/LogD (pH 7.4): 6.04
ACD/BCF (pH 7.4): 22878.47
ACD/KOC (pH 7.4): 45926.53
Polar Surface Area: 34 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 55.3±5.0 dyne/cm
Molar Volume: 285.9±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement