ChemSpider 2D Image | 2-Amino-3-cyano-4-[4-(methoxycarbonyl)phenyl]-4H-chromen-7-yl 6-quinolinecarboxylate | C28H19N3O5

2-Amino-3-cyano-4-[4-(methoxycarbonyl)phenyl]-4H-chromen-7-yl 6-quinolinecarboxylate

  • Molecular FormulaC28H19N3O5
  • Average mass477.468 Da
  • Monoisotopic mass477.132477 Da
  • ChemSpider ID77500625

More details:

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

2-Amino-3-cyan-4-[4-(methoxycarbonyl)phenyl]-4H-chromen-7-yl-6-chinolincarboxylat [German] [ACD/IUPAC Name]
2-Amino-3-cyano-4-[4-(methoxycarbonyl)phenyl]-4H-chromen-7-yl 6-quinolinecarboxylate [ACD/IUPAC Name]
6-Quinoléinecarboxylate de 2-amino-3-cyano-4-[4-(méthoxycarbonyl)phényl]-4H-chromén-7-yle [French] [ACD/IUPAC Name]
6-Quinolinecarboxylic acid, 2-amino-3-cyano-4-[4-(methoxycarbonyl)phenyl]-4H-1-benzopyran-7-yl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 712.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.1±3.0 kJ/mol
Flash Point: 384.4±32.9 °C
Index of Refraction: 1.714
Molar Refractivity: 130.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.31
ACD/LogD (pH 5.5): 4.64
ACD/BCF (pH 5.5): 1985.59
ACD/KOC (pH 5.5): 7927.75
ACD/LogD (pH 7.4): 4.66
ACD/BCF (pH 7.4): 2035.06
ACD/KOC (pH 7.4): 8125.25
Polar Surface Area: 125 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 77.8±5.0 dyne/cm
Molar Volume: 332.0±5.0 cm3

Click to predict properties on the Chemicalize site


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