ChemSpider 2D Image | 2-(1H-Pyrrol-3-ylcarbonyl)butanoate | C9H10NO3

2-(1H-Pyrrol-3-ylcarbonyl)butanoate

  • Molecular FormulaC9H10NO3
  • Average mass180.181 Da
  • Monoisotopic mass180.066620 Da
  • ChemSpider ID32740794

  • Charge - Charge

More details:

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

1H-Pyrrole-3-propanoic acid, α-ethyl-β-oxo-, ion(1-) [ACD/Index Name]
2-(1H-Pyrrol-3-ylcarbonyl)butanoat [German] [ACD/IUPAC Name]
2-(1H-Pyrrol-3-ylcarbonyl)butanoate [ACD/IUPAC Name]
2-(1H-Pyrrol-3-ylcarbonyl)butanoate [French] [ACD/IUPAC Name]
2-(1H-Pyrrole-3-carbonyl)butanoate
887411-89-4 [RN]
Ethyl 3-pyrroloylacetate

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

Density:
Boiling Point: 413.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 203.8±23.2 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.60
ACD/LogD (pH 5.5): -1.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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