Found 82 results

Search term: MF = 'C_{31}H_{47}NO_{4}'
ChemSpider 2D Image | Methyl (3E)-3-(hydroxyimino)-11-oxoolean-12-en-30-oate | C31H47NO4

Methyl (3E)-3-(hydroxyimino)-11-oxoolean-12-en-30-oate

  • Molecular FormulaC31H47NO4
  • Average mass497.709 Da
  • Monoisotopic mass497.350494 Da
  • ChemSpider ID28664558

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3E)-3-(Hydroxyimino)-11-oxooléan-12-én-30-oate de méthyle [French] [ACD/IUPAC Name]
Methyl (3E)-3-(hydroxyimino)-11-oxoolean-12-en-30-oate [ACD/IUPAC Name]
Methyl-(3E)-3-(hydroxyimino)-11-oxoolean-12-en-30-oat [German] [ACD/IUPAC Name]
Olean-12-en-30-oic acid, 3-(hydroxyimino)-11-oxo-, methyl ester, (3E)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 583.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 95.3±6.0 kJ/mol
Flash Point: 306.7±30.1 °C
Index of Refraction: 1.594
Molar Refractivity: 141.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 7.12
ACD/LogD (pH 5.5): 7.18
ACD/BCF (pH 5.5): 167603.00
ACD/KOC (pH 5.5): 191036.98
ACD/LogD (pH 7.4): 7.18
ACD/BCF (pH 7.4): 167600.97
ACD/KOC (pH 7.4): 191034.67
Polar Surface Area: 76 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 42.2±7.0 dyne/cm
Molar Volume: 416.7±7.0 cm3

Click to predict properties on the Chemicalize site


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