ChemSpider 2D Image | N-(2,3-Dihydroxybenzoyl)-O-{2-[(2,3-dihydroxybenzoyl)amino]-3-({2-[(2,3-dihydroxybenzoyl)amino]acryloyl}oxy)propanoyl}serine | C30H27N3O15

N-(2,3-Dihydroxybenzoyl)-O-{2-[(2,3-dihydroxybenzoyl)amino]-3-({2-[(2,3-dihydroxybenzoyl)amino]acryloyl}oxy)propanoyl}serine

  • Molecular FormulaC30H27N3O15
  • Average mass669.547 Da
  • Monoisotopic mass669.144226 Da
  • ChemSpider ID8071752

More details:

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

N-(2,3-Dihydroxybenzoyl)-O-{2-[(2,3-dihydroxybenzoyl)amino]-3-({2-[(2,3-dihydroxybenzoyl)amino]acryloyl}oxy)propanoyl}serin [German] [ACD/IUPAC Name]
N-(2,3-Dihydroxybenzoyl)-O-{2-[(2,3-dihydroxybenzoyl)amino]-3-({2-[(2,3-dihydroxybenzoyl)amino]acryloyl}oxy)propanoyl}serine [ACD/IUPAC Name]
N-(2,3-Dihydroxybenzoyl)-O-{2-[(2,3-dihydroxybenzoyl)amino]-3-({2-[(2,3-dihydroxybenzoyl)amino]acryloyl}oxy)propanoyl}sérine [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 1102.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 169.7±3.0 kJ/mol
Flash Point: 620.5±34.3 °C
Index of Refraction: 1.685
Molar Refractivity: 159.2±0.3 cm3
#H bond acceptors: 18
#H bond donors: 10
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 3.25
ACD/LogD (pH 5.5): -0.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 299 Å2
Polarizability: 63.1±0.5 10-24cm3
Surface Tension: 86.2±3.0 dyne/cm
Molar Volume: 419.1±3.0 cm3

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