ChemSpider 2D Image | Daphnandrine | C36H38N2O6

Daphnandrine

  • Molecular FormulaC36H38N2O6
  • Average mass594.697 Da
  • Monoisotopic mass594.273010 Da
  • ChemSpider ID2713442

More details:

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

6,6',12'-Trimethoxy-2-methyloxyacanthan-7-ol [ACD/IUPAC Name]
6,6',12'-Trimethoxy-2-methyloxyacanthan-7-ol [German] [ACD/IUPAC Name]
6,6',12'-Triméthoxy-2-méthyloxyacanthan-7-ol [French] [ACD/IUPAC Name]
Daphnandrine
1183-76-2 [RN]

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

C09415 [DBID]
P9909Y937X [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 720.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.0±3.0 kJ/mol
Flash Point: 389.3±32.9 °C
Index of Refraction: 1.603
Molar Refractivity: 168.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 2.88
ACD/LogD (pH 5.5): -0.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.35
ACD/BCF (pH 7.4): 17.37
ACD/KOC (pH 7.4): 113.39
Polar Surface Area: 82 Å2
Polarizability: 66.8±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 490.5±3.0 cm3

Click to predict properties on the Chemicalize site


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