ChemSpider 2D Image | N-{(7S)-1,2,10-Trimethoxy-3-[(~3~H_1_)methyloxy]-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide | C22H24TNO6

N-{(7S)-1,2,10-Trimethoxy-3-[(3H1)methyloxy]-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide

  • Molecular FormulaC22H24TNO6
  • Average mass401.445 Da
  • Monoisotopic mass401.176422 Da
  • ChemSpider ID8915140

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

Acetamide, N-[(7S)-5,6,7,9-tetrahydro-1,2,10-trimethoxy-3-(methyl-t-oxy)-9-oxobenzo[a]heptalen-7-yl]- [ACD/Index Name]
N-{(7S)-1,2,10-Trimethoxy-3-[(3H1)methyloxy]-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamid [German] [ACD/IUPAC Name]
N-{(7S)-1,2,10-Trimethoxy-3-[(3H1)methyloxy]-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide [ACD/IUPAC Name]
N-{(7S)-1,2,10-Triméthoxy-3-[(3H1)méthyloxy]-9-oxo-5,6,7,9-tétrahydrobenzo[a]heptalén-7-yl}acétamide [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 726.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.0±3.0 kJ/mol
Flash Point: 392.9±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.92
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 4.06
ACD/KOC (pH 5.5): 94.92
ACD/LogD (pH 7.4): 1.10
ACD/BCF (pH 7.4): 4.06
ACD/KOC (pH 7.4): 94.92
Polar Surface Area: 83 Å2
Polarizability:
Surface Tension:
Molar Volume:

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