ChemSpider 2D Image | MFCD03788772 | C32H50O4

MFCD03788772

  • Molecular FormulaC32H50O4
  • Average mass498.737 Da
  • Monoisotopic mass498.370911 Da
  • ChemSpider ID24534153

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3α)-3-Acetoxyolean-12-en-24-oic acid [ACD/IUPAC Name]
(3α)-3-Acetoxyolean-12-en-24-säure [German] [ACD/IUPAC Name]
(3α,4β)-3-(Acetyloxy)olean-12-en-23-oic acid
3-O-Acetyl-α-boswellic acid
3α-(Acetyloxy)olean-12-en-24-oic acid
3-α-O-acetyl-α-boswellic acid
89913-60-0 [RN]
Acide (3α)-3-acétoxyoléan-12-én-24-oïque [French] [ACD/IUPAC Name]
MFCD03788772
Olean-12-en-24-oic acid, 3-(acetyloxy)-, (3α)- [ACD/Index Name]
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 563.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.3 mmHg at 25°C
    Enthalpy of Vaporization: 92.6±6.0 kJ/mol
    Flash Point: 170.1±23.6 °C
    Index of Refraction: 1.545
    Molar Refractivity: 143.2±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 1
    ACD/LogP: 10.32
    ACD/LogD (pH 5.5): 8.53
    ACD/BCF (pH 5.5): 927830.69
    ACD/KOC (pH 5.5): 295854.00
    ACD/LogD (pH 7.4): 6.74
    ACD/BCF (pH 7.4): 15048.12
    ACD/KOC (pH 7.4): 4798.33
    Polar Surface Area: 64 Å2
    Polarizability: 56.8±0.5 10-24cm3
    Surface Tension: 44.0±5.0 dyne/cm
    Molar Volume: 452.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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