ChemSpider 2D Image | N-[(4-Nitrobenzoyl)carbamoyl]hexopyranosylamine | C14H17N3O9

N-[(4-Nitrobenzoyl)carbamoyl]hexopyranosylamine

  • Molecular FormulaC14H17N3O9
  • Average mass371.299 Da
  • Monoisotopic mass371.096466 Da
  • ChemSpider ID24622595

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

Hexopyranosylamine, N-[[(4-nitrobenzoyl)amino]carbonyl]- [ACD/Index Name]
N-[(4-Nitrobenzoyl)carbamoyl]hexopyranosylamin [German] [ACD/IUPAC Name]
N-[(4-Nitrobenzoyl)carbamoyl]hexopyranosylamine [ACD/IUPAC Name]
N-[(4-Nitrobenzoyl)carbamoyl]hexopyranosylamine [French] [ACD/IUPAC Name]
N-{[(4-nitrophenyl)carbonyl]carbamoyl}-β-D-glucopyranosylamine

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.671
Molar Refractivity: 83.1±0.4 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 0.63
ACD/LogD (pH 5.5): -0.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.86
ACD/LogD (pH 7.4): -0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.15
Polar Surface Area: 194 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 96.9±5.0 dyne/cm
Molar Volume: 222.1±5.0 cm3

Click to predict properties on the Chemicalize site


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