ChemSpider 2D Image | 3-Carbamoyl-1-(dimethylammonio)-4a,7,11-trihydroxy-11-methyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydro-2,5-tetracenediolate | C22H23N2O8

3-Carbamoyl-1-(dimethylammonio)-4a,7,11-trihydroxy-11-methyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydro-2,5-tetracenediolate

  • Molecular FormulaC22H23N2O8
  • Average mass443.427 Da
  • Monoisotopic mass443.145996 Da
  • ChemSpider ID21434518

  • Charge - Charge

More details:

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

2-Naphthacenecarboxamidato, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, inner salt, ion(1-) [ACD/Index Name]
3-Carbamoyl-1-(dimethylammonio)-4a,7,11-trihydroxy-11-methyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydro-2,5-tetracendiolat [German] [ACD/IUPAC Name]
3-Carbamoyl-1-(dimethylammonio)-4a,7,11-trihydroxy-11-methyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydro-2,5-tetracenediolate [ACD/IUPAC Name]
3-Carbamoyl-1-(diméthylammonio)-4a,7,11-trihydroxy-11-méthyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydro-2,5-tétracènediolate [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 790.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.6±3.0 kJ/mol
Flash Point: 432.0±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: -1.47
ACD/LogD (pH 5.5): -3.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 188 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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