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Search term: C12H13NO3 (Found by synonym)

ChemSpider 2D Image | 1-Benzoyl-3-pyrrolidinecarboxylic acid | C12H13NO3

1-Benzoyl-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC12H13NO3
  • Average mass219.236 Da
  • Monoisotopic mass219.089539 Da
  • ChemSpider ID25072714

More details:






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

113558-92-2 [RN]
1-Benzoyl-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
1-Benzoyl-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-benzoyl- [ACD/Index Name]
Acide 1-benzoyl-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
1834430-36-2 [RN]
1-Benzoylpyrrolidin-3-carboxylic acid
1-benzoylpyrrolidine-3-carboxylic acid
1-Benzoyl-pyrrolidine-3-carboxylic acid
1-benzoyl-pyrrolidine-3-carboxylicacid
More...

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 428.9±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 213.2±26.8 °C
Index of Refraction: 1.599
Molar Refractivity: 57.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.04
ACD/LogD (pH 5.5): -0.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.35
ACD/LogD (pH 7.4): -2.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 57.8±3.0 dyne/cm
Molar Volume: 169.0±3.0 cm3

Click to predict properties on the Chemicalize site






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