ChemSpider 2D Image | fusarnapthoquinone A | C15H18O7

fusarnapthoquinone A

  • Molecular FormulaC15H18O7
  • Average mass310.299 Da
  • Monoisotopic mass310.105255 Da
  • ChemSpider ID25054347

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2S,3S,4S)-4,5,8-Trihydroxy-2-(hydroxyméthyl)-6-méthoxy-3-(2-oxopropyl)-3,4-dihydro-1(2H)-naphtalénone [French] [ACD/IUPAC Name]
(2S,3S,4S)-4,5,8-Trihydroxy-2-(hydroxymethyl)-6-methoxy-3-(2-oxopropyl)-3,4-dihydro-1(2H)-naphthalenone [ACD/IUPAC Name]
(2S,3S,4S)-4,5,8-Trihydroxy-2-(hydroxymethyl)-6-methoxy-3-(2-oxopropyl)-3,4-dihydro-1(2H)-naphthalinon [German] [ACD/IUPAC Name]
1(2H)-Naphthalenone, 3,4-dihydro-4,5,8-trihydroxy-2-(hydroxymethyl)-6-methoxy-3-(2-oxopropyl)-, (2S,3S,4S)- [ACD/Index Name]
fusarnapthoquinone A
FUSARNAPHTHOQUINONE A

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

Density: 1.4±0.1 g/cm3
Boiling Point: 561.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 210.2±23.6 °C
Index of Refraction: 1.600
Molar Refractivity: 75.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.08
ACD/LogD (pH 5.5): 0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 27.53
ACD/LogD (pH 7.4): 0.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 24.82
Polar Surface Area: 124 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 62.7±3.0 dyne/cm
Molar Volume: 220.4±3.0 cm3

Click to predict properties on the Chemicalize site


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