ChemSpider 2D Image | (3S,4R)-3-(1,3-Benzodioxol-5-ylcarbonyl)-4-(1,3-benzodioxol-5-ylmethyl)dihydro-2(3H)-furanone | C20H16O7

(3S,4R)-3-(1,3-Benzodioxol-5-ylcarbonyl)-4-(1,3-benzodioxol-5-ylmethyl)dihydro-2(3H)-furanone

  • Molecular FormulaC20H16O7
  • Average mass368.337 Da
  • Monoisotopic mass368.089600 Da
  • ChemSpider ID33823616

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4R)-3-(1,3-Benzodioxol-5-ylcarbonyl)-4-(1,3-benzodioxol-5-ylmethyl)dihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
(3S,4R)-3-(1,3-Benzodioxol-5-ylcarbonyl)-4-(1,3-benzodioxol-5-ylmethyl)dihydro-2(3H)-furanone [ACD/IUPAC Name]
(3S,4R)-3-(1,3-Benzodioxol-5-ylcarbonyl)-4-(1,3-benzodioxol-5-ylméthyl)dihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
2(3H)-Furanone, 3-(1,3-benzodioxol-5-ylcarbonyl)-4-(1,3-benzodioxol-5-ylmethyl)dihydro-, (3S,4R)- [ACD/Index Name]
(3S,4R)-4-(2H-1,3-benzodioxol-5-ylmethyl)-3-(2H-1,3-benzodioxole-5-carbonyl)oxolan-2-one
(3S,4R)-4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(2H-1,3-benzodioxole-5-carbonyl)oxolan-2-one
[130837-92-2] [RN]
130837-92-2 [RN]
7-Oxohikinin
7-Oxohinokinin
More...

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 611.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 90.8±3.0 kJ/mol
    Flash Point: 270.5±31.5 °C
    Index of Refraction: 1.639
    Molar Refractivity: 91.3±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.89
    ACD/LogD (pH 5.5): 2.11
    ACD/BCF (pH 5.5): 23.82
    ACD/KOC (pH 5.5): 336.65
    ACD/LogD (pH 7.4): 2.11
    ACD/BCF (pH 7.4): 23.82
    ACD/KOC (pH 7.4): 336.63
    Polar Surface Area: 80 Å2
    Polarizability: 36.2±0.5 10-24cm3
    Surface Tension: 61.2±3.0 dyne/cm
    Molar Volume: 253.9±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement