ChemSpider 2D Image | (3S)-3,8-Dihydroxy-3,4-dihydro-1(2H)-naphthalenone | C10H10O3

(3S)-3,8-Dihydroxy-3,4-dihydro-1(2H)-naphthalenone

  • Molecular FormulaC10H10O3
  • Average mass178.185 Da
  • Monoisotopic mass178.062988 Da
  • ChemSpider ID78440744

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3,8-Dihydroxy-3,4-dihydro-1(2H)-naphtalénone [French] [ACD/IUPAC Name]
(3S)-3,8-Dihydroxy-3,4-dihydro-1(2H)-naphthalenone [ACD/IUPAC Name]
(3S)-3,8-Dihydroxy-3,4-dihydro-1(2H)-naphthalinon [German] [ACD/IUPAC Name]
1(2H)-Naphthalenone, 3,4-dihydro-3,8-dihydroxy-, (3S)- [ACD/Index Name]
(+)-vermelone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 396.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.2±3.0 kJ/mol
Flash Point: 207.9±24.4 °C
Index of Refraction: 1.648
Molar Refractivity: 46.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.49
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 10.84
ACD/KOC (pH 5.5): 191.54
ACD/LogD (pH 7.4): 1.60
ACD/BCF (pH 7.4): 9.42
ACD/KOC (pH 7.4): 166.53
Polar Surface Area: 58 Å2
Polarizability: 18.5±0.5 10-24cm3
Surface Tension: 67.9±3.0 dyne/cm
Molar Volume: 128.2±3.0 cm3

Click to predict properties on the Chemicalize site


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