Found 51 results

Search term: MF = 'C_{27}H_{31}N_{3}O_{9}'
ChemSpider 2D Image | 2-{[4-(Butoxycarbonyl)phenyl]amino}-2-oxoethyl 1-[(3,4-dimethoxybenzoyl)amino]-5-oxo-3-pyrrolidinecarboxylate | C27H31N3O9

2-{[4-(Butoxycarbonyl)phenyl]amino}-2-oxoethyl 1-[(3,4-dimethoxybenzoyl)amino]-5-oxo-3-pyrrolidinecarboxylate

  • Molecular FormulaC27H31N3O9
  • Average mass541.550 Da
  • Monoisotopic mass541.206055 Da
  • ChemSpider ID68306782

More details:

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

1-[(3,4-Diméthoxybenzoyl)amino]-5-oxo-3-pyrrolidinecarboxylate de 2-{[4-(butoxycarbonyl)phényl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
2-{[4-(Butoxycarbonyl)phenyl]amino}-2-oxoethyl 1-[(3,4-dimethoxybenzoyl)amino]-5-oxo-3-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-{[4-(Butoxycarbonyl)phenyl]amino}-2-oxoethyl-1-[(3,4-dimethoxybenzoyl)amino]-5-oxo-3-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-[(3,4-dimethoxybenzoyl)amino]-5-oxo-, 2-[[4-(butoxycarbonyl)phenyl]amino]-2-oxoethyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.596
Molar Refractivity: 137.6±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 31.58
ACD/KOC (pH 5.5): 412.01
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 31.52
ACD/KOC (pH 7.4): 411.25
Polar Surface Area: 150 Å2
Polarizability: 54.5±0.5 10-24cm3
Surface Tension: 61.4±5.0 dyne/cm
Molar Volume: 404.2±5.0 cm3

Click to predict properties on the Chemicalize site


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