ChemSpider 2D Image | 2-Methoxyethyl 5-[(1-methoxy-3-methyl-2-butanyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate | C17H28N2O5

2-Methoxyethyl 5-[(1-methoxy-3-methyl-2-butanyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

  • Molecular FormulaC17H28N2O5
  • Average mass340.415 Da
  • Monoisotopic mass340.199829 Da
  • ChemSpider ID30242999

More details:

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

1H-Pyrrole-3-carboxylic acid, 5-[[[1-(methoxymethyl)-2-methylpropyl]amino]carbonyl]-2,4-dimethyl-, 2-methoxyethyl ester [ACD/Index Name]
2-Methoxyethyl 5-[(1-methoxy-3-methyl-2-butanyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate [ACD/IUPAC Name]
2-Methoxyethyl-5-[(1-methoxy-3-methyl-2-butanyl)carbamoyl]-2,4-dimethyl-1H-pyrrol-3-carboxylat [German] [ACD/IUPAC Name]
5-[(1-Méthoxy-3-méthyl-2-butanyl)carbamoyl]-2,4-diméthyl-1H-pyrrole-3-carboxylate de 2-méthoxyéthyle [French] [ACD/IUPAC 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: 441.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.9±3.0 kJ/mol
Flash Point: 220.9±28.7 °C
Index of Refraction: 1.507
Molar Refractivity: 91.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.71
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 60.41
ACD/KOC (pH 5.5): 655.41
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 60.41
ACD/KOC (pH 7.4): 655.41
Polar Surface Area: 90 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 307.6±3.0 cm3

Click to predict properties on the Chemicalize site


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