ChemSpider 2D Image | 3-[(Ethylamino)methyl]-1,8-dihydroxy-6-methoxy-9,10-anthraquinone | C18H17NO5

3-[(Ethylamino)methyl]-1,8-dihydroxy-6-methoxy-9,10-anthraquinone

  • Molecular FormulaC18H17NO5
  • Average mass327.331 Da
  • Monoisotopic mass327.110687 Da
  • ChemSpider ID23136361

More details:

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

3-[(Ethylamino)methyl]-1,8-dihydroxy-6-methoxy-9,10-anthrachinon [German] [ACD/IUPAC Name]
3-[(Ethylamino)methyl]-1,8-dihydroxy-6-methoxy-9,10-anthraquinone [ACD/IUPAC Name]
3-[(Éthylamino)méthyl]-1,8-dihydroxy-6-méthoxy-9,10-anthraquinone [French] [ACD/IUPAC Name]
9,10-Anthracenedione, 3-[(ethylamino)methyl]-1,8-dihydroxy-6-methoxy- [ACD/Index Name]
3-Ethylaminomethyl-1,8-dihydroxy-6-methoxy-anthraquinone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 589.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.2±3.0 kJ/mol
Flash Point: 310.3±30.1 °C
Index of Refraction: 1.651
Molar Refractivity: 86.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.57
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.32
ACD/LogD (pH 7.4): 0.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.32
Polar Surface Area: 96 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 62.9±3.0 dyne/cm
Molar Volume: 238.1±3.0 cm3

Click to predict properties on the Chemicalize site


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