ChemSpider 2D Image | Benzyl 2,2-dimethyl-4-oxo-3,8,11,14-tetraoxa-5-azaheptadecan-17-oate | C21H33NO7

Benzyl 2,2-dimethyl-4-oxo-3,8,11,14-tetraoxa-5-azaheptadecan-17-oate

  • Molecular FormulaC21H33NO7
  • Average mass411.489 Da
  • Monoisotopic mass411.225708 Da
  • ChemSpider ID72384065

More details:

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

2,2-Diméthyl-4-oxo-3,8,11,14-tétraoxa-5-azaheptadécan-17-oate de benzyle [French] [ACD/IUPAC Name]
3,8,11,14-Tetraoxa-5-azaheptadecan-17-oic acid, 2,2-dimethyl-4-oxo-, phenylmethyl ester [ACD/Index Name]
Benzyl 2,2-dimethyl-4-oxo-3,8,11,14-tetraoxa-5-azaheptadecan-17-oate [ACD/IUPAC Name]
Benzyl-2,2-dimethyl-4-oxo-3,8,11,14-tetraoxa-5-azaheptadecan-17-oat [German] [ACD/IUPAC Name]
1975173-67-1 [RN]
MFCD30458050
N-Boc-PEG3-benzyl ester

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

Density: 1.1±0.1 g/cm3
Boiling Point: 523.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.7±3.0 kJ/mol
Flash Point: 270.3±28.7 °C
Index of Refraction: 1.495
Molar Refractivity: 108.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 57.91
ACD/KOC (pH 5.5): 635.90
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 57.91
ACD/KOC (pH 7.4): 635.89
Polar Surface Area: 92 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 371.8±3.0 cm3

Click to predict properties on the Chemicalize site


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