ChemSpider 2D Image | (7S,13aS)-10-Hydroxy-2,3,11-trimethoxy-7-methyl-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinolinium | C21H26NO4

(7S,13aS)-10-Hydroxy-2,3,11-trimethoxy-7-methyl-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinolinium

  • Molecular FormulaC21H26NO4
  • Average mass356.435 Da
  • Monoisotopic mass356.185638 Da
  • ChemSpider ID26375002

  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(7S,13aS)-10-Hydroxy-2,3,11-trimethoxy-7-methyl-5,8,13,13a-tetrahydro-6H-isochinolino[3,2-a]isochinolinium [German] [ACD/IUPAC Name]
(7S,13aS)-10-Hydroxy-2,3,11-triméthoxy-7-méthyl-5,8,13,13a-tétrahydro-6H-isoquinoléino[3,2-a]isoquinoléinium [French] [ACD/IUPAC Name]
(7S,13aS)-10-Hydroxy-2,3,11-trimethoxy-7-methyl-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinolinium [ACD/IUPAC Name]
6H-Dibenzo[a,g]quinolizinium, 5,8,13,13a-tetrahydro-10-hydroxy-2,3,11-trimethoxy-7-methyl-, (7S,13aS)- [ACD/Index Name]
(-)-(7S,13aS)-2,3,11-trimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-10-ol
(7S,14S)-(-)-7-Methyl-10-O-demethylxylopinine

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.42
ACD/LogD (pH 5.5): -1.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.13
ACD/LogD (pH 7.4): -1.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.20
Polar Surface Area: 48 Å2
Polarizability:
Surface Tension:
Molar Volume:

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