ChemSpider 2D Image | (7alpha)-12-Hydroxy-11,14-dioxoabieta-8,12-diene-7,16-diyl diacetate | C24H32O7

(7α)-12-Hydroxy-11,14-dioxoabieta-8,12-diene-7,16-diyl diacetate

  • Molecular FormulaC24H32O7
  • Average mass432.507 Da
  • Monoisotopic mass432.214813 Da
  • ChemSpider ID28424420

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

(7α)-12-Hydroxy-11,14-dioxoabieta-8,12-dien-7,16-diyl-diacetat [German] [ACD/IUPAC Name]
(7α)-12-Hydroxy-11,14-dioxoabieta-8,12-diene-7,16-diyl diacetate [ACD/IUPAC Name]
1,4-Phenanthrenedione, 10-(acetyloxy)-2-[2-(acetyloxy)-1-methylethyl]-4b,5,6,7,8,8a,9,10-octahydro-3-hydroxy-4b,8,8-trimethyl-, (4bS,8aS,10R)- [ACD/Index Name]
Diacétate de (7α)-12-hydroxy-11,14-dioxoabiéta-8,12-diène-7,16-diyle [French] [ACD/IUPAC Name]
16-Acetoxy-7-O-acetylhorminone
269742-39-4 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 534.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.2±6.0 kJ/mol
Flash Point: 174.4±23.6 °C
Index of Refraction: 1.546
Molar Refractivity: 111.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.67
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 329.77
ACD/KOC (pH 5.5): 1118.30
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 5.69
ACD/KOC (pH 7.4): 19.29
Polar Surface Area: 107 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 48.6±5.0 dyne/cm
Molar Volume: 351.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement