ChemSpider 2D Image | Ethyl 4-[3-{[4-(ethoxycarbonyl)phenyl]amino}-5-(3-ethoxy-4-hydroxyphenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzoate | C30H30N2O7

Ethyl 4-[3-{[4-(ethoxycarbonyl)phenyl]amino}-5-(3-ethoxy-4-hydroxyphenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzoate

  • Molecular FormulaC30H30N2O7
  • Average mass530.568 Da
  • Monoisotopic mass530.205322 Da
  • ChemSpider ID3785282

More details:

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

4-[3-{[4-(Éthoxycarbonyl)phényl]amino}-5-(3-éthoxy-4-hydroxyphényl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[3-[[4-(ethoxycarbonyl)phenyl]amino]-5-(3-ethoxy-4-hydroxyphenyl)-2,5-dihydro-2-oxo-1H-pyrrol-1-yl]-, ethyl ester [ACD/Index Name]
Ethyl 4-[3-{[4-(ethoxycarbonyl)phenyl]amino}-5-(3-ethoxy-4-hydroxyphenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzoate [ACD/IUPAC Name]
Ethyl-4-[3-{[4-(ethoxycarbonyl)phenyl]amino}-5-(3-ethoxy-4-hydroxyphenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzoat [German] [ACD/IUPAC Name]
ethyl 4-({1-[4-(ethoxycarbonyl)phenyl]-5-(3-ethoxy-4-hydroxyphenyl)-2-oxo-3-pyrrolin-3-yl}amino)benzoate
ETHYL 4-[5-(3-ETHOXY-4-HYDROXYPHENYL)-3-{[4-(ETHOXYCARBONYL)PHENYL]AMINO}-2-OXO-5H-PYRROL-1-YL]BENZOATE

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

A2891/0121768 [DBID]
NCGC00102600-01 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 703.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.7±3.0 kJ/mol
Flash Point: 379.5±32.9 °C
Index of Refraction: 1.633
Molar Refractivity: 145.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 4.89
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 1366.38
ACD/KOC (pH 5.5): 6109.90
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1361.03
ACD/KOC (pH 7.4): 6085.97
Polar Surface Area: 114 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 57.6±3.0 dyne/cm
Molar Volume: 408.6±3.0 cm3

Click to predict properties on the Chemicalize site


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