ChemSpider 2D Image | 11-(3-Ammonio-3-carboxylatopropanoyl)-1,5-dihydroxy-12H-pyrido[3,2-a]phenoxazine-3-carboxylate | C20H14N3O8

11-(3-Ammonio-3-carboxylatopropanoyl)-1,5-dihydroxy-12H-pyrido[3,2-a]phenoxazine-3-carboxylate

  • Molecular FormulaC20H14N3O8
  • Average mass424.341 Da
  • Monoisotopic mass424.078644 Da
  • ChemSpider ID26330883

  • Charge - Charge

More details:

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

11-(3-Ammonio-3-carboxylatopropanoyl)-1,5-dihydroxy-12H-pyrido[3,2-a]phenoxazin-3-carboxylat [German] [ACD/IUPAC Name]
11-(3-Ammonio-3-carboxylatopropanoyl)-1,5-dihydroxy-12H-pyrido[3,2-a]phenoxazine-3-carboxylate [ACD/IUPAC Name]
11-(3-Ammonio-3-carboxylatopropanoyl)-1,5-dihydroxy-12H-pyrido[3,2-a]phénoxazine-3-carboxylate [French] [ACD/IUPAC Name]
12H-Pyrido[3,2-a]phenoxazine-11-butanoic acid, α-amino-3-carboxy-1,5-dihydroxy-γ-oxo-, inner salt, ion(1-) [ACD/Index Name]
11-(3-azaniumyl-3-carboxylatopropanoyl)-1,5-dihydroxy-12H-pyrido[3,2-a]phenoxazine-3-carboxylate
5,12-Dihydroxanthommatin
5,12-dihydroxanthommatin anion
5,12-dihydroxanthommatin(1-)
  • Miscellaneous

    • Chemical Class:

      Conjugate base of 5,12-dihydroxanthommatin having anionic carboxy groups and a protonated primary amino group. ChEBI CHEBI:57710

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

Density:
Boiling Point: 869.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 132.3±3.0 kJ/mol
Flash Point: 479.4±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 4.24
ACD/LogD (pH 5.5): -1.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 200 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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