ChemSpider 2D Image | 3-{[Bis(2-hydroxyethyl)amino]methyl}-1,8-dihydroxy-6-methoxy-9,10-anthraquinone | C20H21NO7

3-{[Bis(2-hydroxyethyl)amino]methyl}-1,8-dihydroxy-6-methoxy-9,10-anthraquinone

  • Molecular FormulaC20H21NO7
  • Average mass387.383 Da
  • Monoisotopic mass387.131805 Da
  • ChemSpider ID23136524

More details:

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

3-{[Bis(2-hydroxyethyl)amino]methyl}-1,8-dihydroxy-6-methoxy-9,10-anthrachinon [German] [ACD/IUPAC Name]
3-{[Bis(2-hydroxyethyl)amino]methyl}-1,8-dihydroxy-6-methoxy-9,10-anthraquinone [ACD/IUPAC Name]
3-{[Bis(2-hydroxyéthyl)amino]méthyl}-1,8-dihydroxy-6-méthoxy-9,10-anthraquinone [French] [ACD/IUPAC Name]
9,10-Anthracenedione, 3-[[bis(2-hydroxyethyl)amino]methyl]-1,8-dihydroxy-6-methoxy- [ACD/Index Name]
3-{[Bis-(2-hydroxy-ethyl)-amino]-methyl}-1,8-dihydroxy-6-methoxy-anthraquinone

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

Density: 1.5±0.1 g/cm3
Boiling Point: 691.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.4±3.0 kJ/mol
Flash Point: 372.1±31.5 °C
Index of Refraction: 1.675
Molar Refractivity: 99.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.99
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 2.30
ACD/KOC (pH 5.5): 24.05
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.69
Polar Surface Area: 128 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 76.7±3.0 dyne/cm
Molar Volume: 264.5±3.0 cm3

Click to predict properties on the Chemicalize site


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