ChemSpider 2D Image | Ethyl 1,3,5-trimethyl-4-{N-[(2-methyl-2-propanyl)carbamoyl]-N-(tetrahydro-2-furanylmethyl)glycyl}-1H-pyrrole-2-carboxylate | C22H35N3O5

Ethyl 1,3,5-trimethyl-4-{N-[(2-methyl-2-propanyl)carbamoyl]-N-(tetrahydro-2-furanylmethyl)glycyl}-1H-pyrrole-2-carboxylate

  • Molecular FormulaC22H35N3O5
  • Average mass421.530 Da
  • Monoisotopic mass421.257660 Da
  • ChemSpider ID22632828

More details:

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

1,3,5-Triméthyl-4-{N-[(2-méthyl-2-propanyl)carbamoyl]-N-(tétrahydro-2-furanylméthyl)glycyl}-1H-pyrrole-2-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1H-Pyrrole-2-carboxylic acid, 4-[2-[[[(1,1-dimethylethyl)amino]carbonyl][(tetrahydro-2-furanyl)methyl]amino]acetyl]-1,3,5-trimethyl-, ethyl ester [ACD/Index Name]
Ethyl 1,3,5-trimethyl-4-{N-[(2-methyl-2-propanyl)carbamoyl]-N-(tetrahydro-2-furanylmethyl)glycyl}-1H-pyrrole-2-carboxylate [ACD/IUPAC Name]
Ethyl-1,3,5-trimethyl-4-{N-[(2-methyl-2-propanyl)carbamoyl]-N-(tetrahydro-2-furanylmethyl)glycyl}-1H-pyrrol-2-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 628.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.0±3.0 kJ/mol
Flash Point: 333.9±31.5 °C
Index of Refraction: 1.548
Molar Refractivity: 114.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 3.45
ACD/BCF (pH 5.5): 246.27
ACD/KOC (pH 5.5): 1792.16
ACD/LogD (pH 7.4): 3.45
ACD/BCF (pH 7.4): 246.27
ACD/KOC (pH 7.4): 1792.15
Polar Surface Area: 90 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 39.1±7.0 dyne/cm
Molar Volume: 359.9±7.0 cm3

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