Found 5 results

Search term: MF = 'C_{24}H_{37}BrO_{5}'
ChemSpider 2D Image | (1S,3R,4S,4aS,4bS,8R,8aS,9R,10aR)-8-Bromo-1-hydroxy-4-isopropyl-1,8a-dimethyl-5-methylenetetradecahydrophenanthrene-3,9-diyl diacetate | C24H37BrO5

(1S,3R,4S,4aS,4bS,8R,8aS,9R,10aR)-8-Bromo-1-hydroxy-4-isopropyl-1,8a-dimethyl-5-methylenetetradecahydrophenanthrene-3,9-diyl diacetate

  • Molecular FormulaC24H37BrO5
  • Average mass485.452 Da
  • Monoisotopic mass484.182434 Da
  • ChemSpider ID27023259

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(1S,3R,4S,4aS,4bS,8R,8aS,9R,10aR)-8-Brom-1-hydroxy-4-isopropyl-1,8a-dimethyl-5-methylentetradecahydrophenanthren-3,9-diyl-diacetat [German] [ACD/IUPAC Name]
(1S,3R,4S,4aS,4bS,8R,8aS,9R,10aR)-8-Bromo-1-hydroxy-4-isopropyl-1,8a-dimethyl-5-methylenetetradecahydrophenanthrene-3,9-diyl diacetate [ACD/IUPAC Name]
1,3,9-Phenanthrenetriol, 8-bromotetradecahydro-1,8a-dimethyl-5-methylene-4-(1-methylethyl)-, 3,9-diacetate, (1S,3R,4S,4aS,4bS,8R,8aS,9R,10aR)- [ACD/Index Name]
Diacétate de (1S,3R,4S,4aS,4bS,8R,8aS,9R,10aR)-8-bromo-1-hydroxy-4-isopropyl-1,8a-diméthyl-5-méthylènetétradécahydrophénanthrène-3,9-diyle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 506.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 89.4±6.0 kJ/mol
Flash Point: 260.0±30.1 °C
Index of Refraction: 1.535
Molar Refractivity: 119.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.00
ACD/LogD (pH 5.5): 5.21
ACD/BCF (pH 5.5): 5406.44
ACD/KOC (pH 5.5): 16353.50
ACD/LogD (pH 7.4): 5.21
ACD/BCF (pH 7.4): 5406.44
ACD/KOC (pH 7.4): 16353.50
Polar Surface Area: 73 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 43.7±5.0 dyne/cm
Molar Volume: 383.2±5.0 cm3

Click to predict properties on the Chemicalize site


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