ChemSpider 2D Image | 2-Chloro-3-(3-methyl-2-buten-1-yl)-2,3-dihydro-1,4-naphthalenedione | C15H15ClO2

2-Chloro-3-(3-methyl-2-buten-1-yl)-2,3-dihydro-1,4-naphthalenedione

  • Molecular FormulaC15H15ClO2
  • Average mass262.731 Da
  • Monoisotopic mass262.076050 Da
  • ChemSpider ID24614166

More details:






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

1,4-Naphthalenedione, 2-chloro-2,3-dihydro-3-(3-methyl-2-buten-1-yl)- [ACD/Index Name]
2-Chlor-3-(3-methyl-2-buten-1-yl)-2,3-dihydro-1,4-naphthalindion [German] [ACD/IUPAC Name]
2-Chloro-3-(3-méthyl-2-butén-1-yl)-2,3-dihydro-1,4-naphtalènedione [French] [ACD/IUPAC Name]
2-Chloro-3-(3-methyl-2-buten-1-yl)-2,3-dihydro-1,4-naphthalenedione [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 405.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.8±3.0 kJ/mol
Flash Point: 171.5±29.3 °C
Index of Refraction: 1.564
Molar Refractivity: 71.1±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 3.89
ACD/BCF (pH 5.5): 528.51
ACD/KOC (pH 5.5): 3095.75
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 528.51
ACD/KOC (pH 7.4): 3095.75
Polar Surface Area: 34 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 43.7±5.0 dyne/cm
Molar Volume: 218.6±5.0 cm3

Click to predict properties on the Chemicalize site






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