ChemSpider 2D Image | 2-Methyl-2-propanyl 1-{4-[(1Z)-2-cyano-3-(2-ethoxyethoxy)-3-oxo-1-propen-1-yl]phenyl}-1-oxo-5,8,11,14-tetraoxa-2-azaheptadecan-17-oate | C30H44N2O10

2-Methyl-2-propanyl 1-{4-[(1Z)-2-cyano-3-(2-ethoxyethoxy)-3-oxo-1-propen-1-yl]phenyl}-1-oxo-5,8,11,14-tetraoxa-2-azaheptadecan-17-oate

  • Molecular FormulaC30H44N2O10
  • Average mass592.678 Da
  • Monoisotopic mass592.299622 Da
  • ChemSpider ID102512751

  • Double-bond stereo - Double-bond stereo

More details:

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

1-{4-[(1Z)-2-Cyano-3-(2-éthoxyéthoxy)-3-oxo-1-propén-1-yl]phényl}-1-oxo-5,8,11,14-tétraoxa-2-azaheptadécan-17-oate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 1-{4-[(1Z)-2-cyano-3-(2-ethoxyethoxy)-3-oxo-1-propen-1-yl]phenyl}-1-oxo-5,8,11,14-tetraoxa-2-azaheptadecan-17-oate [ACD/IUPAC Name]
2-Methyl-2-propanyl-1-{4-[(1Z)-2-cyan-3-(2-ethoxyethoxy)-3-oxo-1-propen-1-yl]phenyl}-1-oxo-5,8,11,14-tetraoxa-2-azaheptadecan-17-oat [German] [ACD/IUPAC Name]
5,8,11,14-Tetraoxa-2-azaheptadecan-17-oic acid, 1-[4-[(1Z)-2-cyano-3-(2-ethoxyethoxy)-3-oxo-1-propen-1-yl]phenyl]-1-oxo-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 731.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.8±3.0 kJ/mol
Flash Point: 396.3±32.9 °C
Index of Refraction: 1.515
Molar Refractivity: 155.8±0.3 cm3
#H bond acceptors: 12
#H bond donors: 1
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 2
ACD/LogP: 1.13
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 21.65
ACD/KOC (pH 5.5): 314.43
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 21.65
ACD/KOC (pH 7.4): 314.43
Polar Surface Area: 152 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 43.6±3.0 dyne/cm
Molar Volume: 516.4±3.0 cm3

Click to predict properties on the Chemicalize site


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