ChemSpider 2D Image | (-)-corycavine | C21H21NO5

(-)-corycavine

  • Molecular FormulaC21H21NO5
  • Average mass367.395 Da
  • Monoisotopic mass367.141968 Da
  • ChemSpider ID34988310

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(-)-corycavine
(16S)-7,16-Dimethyl-6,8,9,16-tetrahydrobis[1,3]benzodioxolo[4,5-c:5',6'-g]azecin-15(7H)-on [German] [ACD/IUPAC Name]
(16S)-7,16-Dimethyl-6,8,9,16-tetrahydrobis[1,3]benzodioxolo[4,5-c:5',6'-g]azecin-15(7H)-one [ACD/IUPAC Name]
(16S)-7,16-Diméthyl-6,8,9,16-tétrahydrobis[1,3]benzodioxolo[4,5-c:5',6'-g]azécin-15(7H)-one [French] [ACD/IUPAC Name]
144606-40-6 [RN]
Bis[1,3]benzodioxolo[4,5-c:5',6'-g]azecin-15(7H)-one, 6,8,9,16-tetrahydro-7,16-dimethyl-, (16S)- [ACD/Index Name]
521-87-9 [RN]
CORYCAVAMINE, (±)-
CORYCAVINE, (-)-
UNII-DM85L9FV7N

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

950XPW1NO8 [DBID]
UNII:950XPW1NO8 [DBID]
UNII-950XPW1NO8 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 534.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±3.0 kJ/mol
Flash Point: 277.1±30.1 °C
Index of Refraction: 1.596
Molar Refractivity: 97.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.25
ACD/LogD (pH 5.5): 0.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.14
ACD/LogD (pH 7.4): 2.67
ACD/BCF (pH 7.4): 45.11
ACD/KOC (pH 7.4): 359.74
Polar Surface Area: 57 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 286.9±3.0 cm3

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