ChemSpider 2D Image | 3-ACETOXY-3-METHYLPENTANE-1,5-DIOIC ACID ANHYDRIDE | C8H10O5

3-ACETOXY-3-METHYLPENTANE-1,5-DIOIC ACID ANHYDRIDE

  • Molecular FormulaC8H10O5
  • Average mass186.162 Da
  • Monoisotopic mass186.052826 Da
  • ChemSpider ID21501011

More details:

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

2H-Pyran-2,6(3H)-dione, 4-(acetyloxy)dihydro-4-methyl- [ACD/Index Name]
3-ACETOXY-3-METHYLPENTANE-1,5-DIOIC ACID ANHYDRIDE
4-Methyl-2,6-dioxotetrahydro-2H-pyran-4-yl acetate [ACD/IUPAC Name]
4-Methyl-2,6-dioxotetrahydro-2H-pyran-4-yl-acetat [German] [ACD/IUPAC Name]
87894-65-3 [RN]
Acétate de 4-méthyl-2,6-dioxotétrahydro-2H-pyran-4-yle [French] [ACD/IUPAC Name]
(4-methyl-2,6-dioxooxan-4-yl) acetate
4-(Acetyloxy)dihydro-4-methyl-
4-(Acetyloxy)dihydro-4-methyl-2H-pyran-2,6(3H)-dione
4-METHYL-2,6-DIOXOOXAN-4-YL ACETATE
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 300.6±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.1±3.0 kJ/mol
    Flash Point: 132.7±26.0 °C
    Index of Refraction: 1.469
    Molar Refractivity: 40.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.58
    ACD/LogD (pH 5.5): -0.48
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 13.10
    ACD/LogD (pH 7.4): -0.48
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 13.10
    Polar Surface Area: 70 Å2
    Polarizability: 16.2±0.5 10-24cm3
    Surface Tension: 41.9±5.0 dyne/cm
    Molar Volume: 146.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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