ChemSpider 2D Image | 2-(Phenylethynyl)-1,4-benzoquinone | C14H8O2

2-(Phenylethynyl)-1,4-benzoquinone

  • Molecular FormulaC14H8O2
  • Average mass208.212 Da
  • Monoisotopic mass208.052429 Da
  • ChemSpider ID28705421

More details:

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

2-(Phenylethinyl)-1,4-benzochinon [German] [ACD/IUPAC Name]
2-(Phenylethynyl)-1,4-benzoquinone [ACD/IUPAC Name]
2-(Phényléthynyl)-1,4-benzoquinone [French] [ACD/IUPAC Name]
2,5-Cyclohexadiene-1,4-dione, 2-(2-phenylethynyl)- [ACD/Index Name]
2-(Phenylethynyl)cyclohexa-2,5-diene-1,4-dione
2,5-CYCLOHEXADIENE-1,4-DIONE, 2-(PHENYLETHYNYL)-
89845-28-3 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 340.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.4±3.0 kJ/mol
Flash Point: 127.8±24.9 °C
Index of Refraction: 1.634
Molar Refractivity: 59.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 2.80
ACD/BCF (pH 5.5): 79.53
ACD/KOC (pH 5.5): 797.98
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 79.53
ACD/KOC (pH 7.4): 797.98
Polar Surface Area: 34 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 55.0±5.0 dyne/cm
Molar Volume: 166.7±5.0 cm3

Click to predict properties on the Chemicalize site


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