ChemSpider 2D Image | MFCD09264209 | C22H23NO5

MFCD09264209

  • Molecular FormulaC22H23NO5
  • Average mass381.422 Da
  • Monoisotopic mass381.157623 Da
  • ChemSpider ID23894815

More details:






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

2H-Pyran-4-carboxylic acid, 4-[[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]methyl]tetrahydro- [ACD/Index Name]
4-({[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}methyl)tetrahydro-2H-pyran-4-carbonsäure [German] [ACD/IUPAC Name]
4-({[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}methyl)tetrahydro-2H-pyran-4-carboxylic acid [ACD/IUPAC Name]
Acide 4-({[(9H-fluorén-9-ylméthoxy)carbonyl]amino}méthyl)tétrahydro-2H-pyrane-4-carboxylique [French] [ACD/IUPAC Name]
MFCD09264209
[946716-29-6] [RN]
4-(((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)methyl)tetrahydro-2H-pyran-4-carboxylic acid
4-({[(9H-fluoren-9-ylmethoxy)carbonyl]amino}methyl)oxane-4-carboxylic acid
4-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]oxane-4-carboxylic acid
946716-29-6 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 616.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.2±3.0 kJ/mol
Flash Point: 326.9±28.7 °C
Index of Refraction: 1.597
Molar Refractivity: 101.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 14.94
ACD/KOC (pH 5.5): 96.35
ACD/LogD (pH 7.4): 0.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.69
Polar Surface Area: 85 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 298.9±3.0 cm3

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