ChemSpider 2D Image | 3-Ethyl-1-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-azetidinecarboxylic acid | C21H21NO4

3-Ethyl-1-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-azetidinecarboxylic acid

  • Molecular FormulaC21H21NO4
  • Average mass351.396 Da
  • Monoisotopic mass351.147064 Da
  • ChemSpider ID81364029

More details:

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

1,3-Azetidinedicarboxylic acid, 3-ethyl-, 1-(9H-fluoren-9-ylmethyl) ester [ACD/Index Name]
3-Ethyl-1-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-azetidincarbonsäure [German] [ACD/IUPAC Name]
3-Ethyl-1-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-azetidinecarboxylic acid [ACD/IUPAC Name]
Acide 3-éthyl-1-[(9H-fluorén-9-ylméthoxy)carbonyl]-3-azétidinecarboxylique [French] [ACD/IUPAC Name]
2280718-19-4 [RN]
3-ethyl-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}azetidine-3-carboxylic acid
MFCD32269274

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

Density: 1.3±0.1 g/cm3
Boiling Point: 545.3±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.7±3.0 kJ/mol
Flash Point: 283.6±28.2 °C
Index of Refraction: 1.619
Molar Refractivity: 95.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 2.47
ACD/BCF (pH 5.5): 21.58
ACD/KOC (pH 5.5): 133.91
ACD/LogD (pH 7.4): 0.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.24
Polar Surface Area: 67 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 55.7±3.0 dyne/cm
Molar Volume: 272.3±3.0 cm3

Click to predict properties on the Chemicalize site


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