ChemSpider 2D Image | (20Z)-4-Methyl-6-oxostigmasta-7,20(22)-dien-3-yl benzoate | C37H52O3

(20Z)-4-Methyl-6-oxostigmasta-7,20(22)-dien-3-yl benzoate

  • Molecular FormulaC37H52O3
  • Average mass544.807 Da
  • Monoisotopic mass544.391663 Da
  • ChemSpider ID4520538

  • Double-bond stereo - Double-bond stereo

More details:

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

(20Z)-4-Methyl-6-oxostigmasta-7,20(22)-dien-3-yl benzoate [ACD/IUPAC Name]
(20Z)-4-Methyl-6-oxostigmasta-7,20(22)-dien-3-yl-benzoat [German] [ACD/IUPAC Name]
Benzoate de (20Z)-4-méthyl-6-oxostigmasta-7,20(22)-dién-3-yle [French] [ACD/IUPAC Name]
Stigmasta-7,20(22)-dien-6-one, 3-(benzoyloxy)-4-methyl-, (20Z)- [ACD/Index Name]
Carpesterol dehydrate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 621.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 254.9±31.5 °C
Index of Refraction: 1.553
Molar Refractivity: 163.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 11.47
ACD/LogD (pH 5.5): 10.06
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 7043566.50
ACD/LogD (pH 7.4): 10.06
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 7043566.50
Polar Surface Area: 43 Å2
Polarizability: 64.7±0.5 10-24cm3
Surface Tension: 42.4±5.0 dyne/cm
Molar Volume: 510.3±5.0 cm3

Click to predict properties on the Chemicalize site


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