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Search term: FKJHUXWRDKKLHI (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-(3,4-Dimethoxyphenyl)-1-isopropyl-5-oxo-3-pyrrolidinecarboxylic acid | C16H21NO5

2-(3,4-Dimethoxyphenyl)-1-isopropyl-5-oxo-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC16H21NO5
  • Average mass307.342 Da
  • Monoisotopic mass307.141968 Da
  • ChemSpider ID24797079

More details:

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

2-(3,4-Dimethoxyphenyl)-1-isopropyl-5-oxo-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
2-(3,4-Dimethoxyphenyl)-1-isopropyl-5-oxo-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 2-(3,4-dimethoxyphenyl)-1-(1-methylethyl)-5-oxo- [ACD/Index Name]
Acide 2-(3,4-diméthoxyphényl)-1-isopropyl-5-oxo-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
1239761-14-8 [RN]
2-(3,4-dimethoxyphenyl)-1-isopropyl-5-oxopyrrolidine-3-carboxylic acid
2-(3,4-Dimethoxy-phenyl)-1-isopropyl-5-oxo-pyrrolidine-3-carboxylic acid
2-(3,4-dimethoxyphenyl)-5-oxo-1-(propan-2-yl)pyrrolidine-3-carboxylic acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 503.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 258.3±30.1 °C
Index of Refraction: 1.545
Molar Refractivity: 79.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.51
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.26
ACD/LogD (pH 7.4): -1.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 252.8±3.0 cm3

Click to predict properties on the Chemicalize site


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