ChemSpider 2D Image | (1R,14S,15S,16R)-4,5,6,9,10,11-Hexamethoxy-15,16-dimethyl-17-oxatetracyclo[12.2.1.0~2,7~.0~8,13~]heptadeca-2,4,6,8,10,12-hexaene | C24H30O7

(1R,14S,15S,16R)-4,5,6,9,10,11-Hexamethoxy-15,16-dimethyl-17-oxatetracyclo[12.2.1.02,7.08,13]heptadeca-2,4,6,8,10,12-hexaene

  • Molecular FormulaC24H30O7
  • Average mass430.491 Da
  • Monoisotopic mass430.199158 Da
  • ChemSpider ID57256987

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1R,14S,15S,16R)-4,5,6,9,10,11-Hexamethoxy-15,16-dimethyl-17-oxatetracyclo[12.2.1.02,7.08,13]heptadeca-2,4,6,8,10,12-hexaen [German] [ACD/IUPAC Name]
(1R,14S,15S,16R)-4,5,6,9,10,11-Hexamethoxy-15,16-dimethyl-17-oxatetracyclo[12.2.1.02,7.08,13]heptadeca-2,4,6,8,10,12-hexaene [ACD/IUPAC Name]
(1R,14S,15S,16R)-4,5,6,9,10,11-Hexaméthoxy-15,16-diméthyl-17-oxatétracyclo[12.2.1.02,7.08,13]heptadéca-2,4,6,8,10,12-hexaène [French] [ACD/IUPAC Name]
5,8-Epoxydibenzo[a,c]cyclooctene, 5,6,7,8-tetrahydro-1,2,3,10,11,12-hexamethoxy-6,7-dimethyl-, (5R,6R,7S,8S)- [ACD/Index Name]
(1R,14S,15S,16R)-4,5,6,9,10,11-Hexamethoxy-15,16-dimethyl-17-oxatetracyclo[12.2.1.02,7.08,13]heptadeca-2,4,6,8,10,12-hexaene
163564-58-7 [RN]
kadsulignan N

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

Density: 1.1±0.1 g/cm3
Boiling Point: 545.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 217.0±30.0 °C
Index of Refraction: 1.535
Molar Refractivity: 116.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 414.12
ACD/KOC (pH 5.5): 2599.81
ACD/LogD (pH 7.4): 3.75
ACD/BCF (pH 7.4): 414.12
ACD/KOC (pH 7.4): 2599.81
Polar Surface Area: 65 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 375.3±3.0 cm3

Click to predict properties on the Chemicalize site


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