ChemSpider 2D Image | 4-[2-(Methylamino)propyl]-1,2-benzoquinone | C10H13NO2

4-[2-(Methylamino)propyl]-1,2-benzoquinone

  • Molecular FormulaC10H13NO2
  • Average mass179.216 Da
  • Monoisotopic mass179.094635 Da
  • ChemSpider ID60671004

More details:






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

3,5-Cyclohexadiene-1,2-dione, 4-[2-(methylamino)propyl]- [ACD/Index Name]
4-[2-(Methylamino)propyl]-1,2-benzochinon [German] [ACD/IUPAC Name]
4-[2-(Methylamino)propyl]-1,2-benzoquinone [ACD/IUPAC Name]
4-[2-(Méthylamino)propyl]-1,2-benzoquinone [French] [ACD/IUPAC Name]
351871-06-2 [RN]
MFCD24648450

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

Density: 1.1±0.1 g/cm3
Boiling Point: 299.2±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.9±3.0 kJ/mol
Flash Point: 125.0±25.3 °C
Index of Refraction: 1.514
Molar Refractivity: 49.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.48
ACD/LogD (pH 5.5): -3.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 46 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 163.8±3.0 cm3

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