Found 91 results

Search term: MF = 'C_{29}H_{39}NO_{6}'
ChemSpider 2D Image | Zoaramine | C29H39NO6

Zoaramine

  • Molecular FormulaC29H39NO6
  • Average mass497.623 Da
  • Monoisotopic mass497.277740 Da
  • ChemSpider ID30919024

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(4aR,4bS,5R,6aS,8Z,10aS,10bR,12aS)-5-Hydroxy-8-[(4R,6R)-6-hydroxy-4-methyl-2-azepanyliden]-3,4b,6a,10a-tetramethyl-4,4a,4b,7,8,10,10a,10b,12,12a-decahydro-1,6,9,11(5H,6aH)-chrysentetron [German] [ACD/IUPAC Name]
(4aR,4bS,5R,6aS,8Z,10aS,10bR,12aS)-5-Hydroxy-8-[(4R,6R)-6-hydroxy-4-methyl-2-azepanylidene]-3,4b,6a,10a-tetramethyl-4,4a,4b,7,8,10,10a,10b,12,12a-decahydro-1,6,9,11(5H,6aH)-chrysenetetrone [ACD/IUPAC Name]
(4aR,4bS,5R,6aS,8Z,10aS,10bR,12aS)-5-Hydroxy-8-[(4R,6R)-6-hydroxy-4-méthyl-2-azépanylidène]-3,4b,6a,10a-tétraméthyl-4,4a,4b,7,8,10,10a,10b,12,12a-décahydro-1,6,9,11(5H,6aH)-chrysènetétrone [French] [ACD/IUPAC Name]
1,6,9,11(5H,6aH)-Chrysenetetrone, 8-[(4R,6R)-hexahydro-6-hydroxy-4-methyl-2H-azepin-2-ylidene]-4,4a,4b,7,8,10,10a,10b,12,12a-decahydro-5-hydroxy-3,4b,6a,10a-tetramethyl-, (4aR,4bS,5R,6aS,8Z,10aS,10bR, 12aS)- [ACD/Index Name]
Zoaramine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 699.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 117.1±6.0 kJ/mol
Flash Point: 376.8±31.5 °C
Index of Refraction: 1.574
Molar Refractivity: 132.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.29
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 9.47
ACD/KOC (pH 5.5): 152.74
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 14.84
ACD/KOC (pH 7.4): 239.49
Polar Surface Area: 121 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 401.0±3.0 cm3

Click to predict properties on the Chemicalize site


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