ChemSpider 2D Image | Bolazine | C40H64N2O2

Bolazine

  • Molecular FormulaC40H64N2O2
  • Average mass604.948 Da
  • Monoisotopic mass604.496765 Da
  • ChemSpider ID16736833
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 16 of 16 defined stereocentres


More details:






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

(2α,3E,5α,17β,2'α,3'E,5'α,17'β)-3,3'-[(1E,2E)-1,2-Hydrazindiyliden]bis(2-methylandrostan-17-ol) [German] [ACD/IUPAC Name]
(2α,3E,5α,17β,2'α,3'E,5'α,17'β)-3,3'-[(1E,2E)-1,2-Hydrazinediylidene]bis(2-methylandrostan-17-ol) [ACD/IUPAC Name]
(2α,3E,5α,17β,2'α,3'E,5'α,17'β)-3,3'-[(1E,2E)-1,2-Hydrazinediylidène]bis(2-méthylandrostan-17-ol) [French] [ACD/IUPAC Name]
17b-Hydroxy-2a-methyl-5a-androstan-3-one Azine
17β-Hydroxy-2α-methyl-5α-androstan-3-one azine
2604
4267-81-6 [RN]
508ISH42Z9
Androstan-3-one, 17-hydroxy-2-methyl-, 2-[(2α,3E,5α,17β)-17-hydroxy-2-methylandrostan-3-ylidene]hydrazone, (2α,3E,5α,17β)- [ACD/Index Name]
bolazina [Spanish] [INN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 678.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 114.0±6.0 kJ/mol
Flash Point: 470.3±20.8 °C
Index of Refraction: 1.674
Molar Refractivity: 175.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 2
ACD/LogP: 8.94
ACD/LogD (pH 5.5): 6.46
ACD/BCF (pH 5.5): 15970.43
ACD/KOC (pH 5.5): 9607.34
ACD/LogD (pH 7.4): 6.62
ACD/BCF (pH 7.4): 23049.06
ACD/KOC (pH 7.4): 13865.63
Polar Surface Area: 65 Å2
Polarizability: 69.5±0.5 10-24cm3
Surface Tension: 47.3±7.0 dyne/cm
Molar Volume: 467.4±7.0 cm3

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