ChemSpider 2D Image | 6-[(3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl)oxy]-3-iodo-2-methyltetrahydro-2H-pyran-4-aminium | C27H29INO10

6-[(3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl)oxy]-3-iodo-2-methyltetrahydro-2H-pyran-4-aminium

  • Molecular FormulaC27H29INO10
  • Average mass654.424 Da
  • Monoisotopic mass654.083069 Da
  • ChemSpider ID3820627

  • Charge - Charge

More details:

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

2H-Pyran-4-aminium, 6-[[1,2,3,4,6,11-hexahydro-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-1-naphthacenyl]oxy]tetrahydro-3-iodo-2-methyl- [ACD/Index Name]
3-Iodo-2-méthyl-6-{[3,5,12-trihydroxy-3-(2-hydroxyacétyl)-10-méthoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tétracényl]oxy}tétrahydro-2H-pyran-4-aminium [French] [ACD/IUPAC Name]
6-[(3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl)oxy]-3-iod-2-methyltetrahydro-2H-pyran-4-aminium [German] [ACD/IUPAC Name]
6-[(3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl)oxy]-3-iodo-2-methyltetrahydro-2H-pyran-4-aminium [ACD/IUPAC Name]

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

Density:
Boiling Point: 813.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 123.9±3.0 kJ/mol
Flash Point: 445.6±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: 4.28
ACD/LogD (pH 5.5): -0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.27
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 1.67
ACD/KOC (pH 7.4): 19.65
Polar Surface Area: 187 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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