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Search term: DATA_SOURCE in ('Sigma-Aldrich Compliance')
ChemSpider 2D Image | alpha-Pyrrolidinobutiophenone | C14H19NO

α-Pyrrolidinobutiophenone

  • Molecular FormulaC14H19NO
  • Average mass217.307 Da
  • Monoisotopic mass217.146667 Da
  • ChemSpider ID16251917

More details:

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

?-pyrrolidinobutiophenone
13415-82-2 [RN]
1-Butanone, 1-phenyl-2-(1-pyrrolidinyl)- [ACD/Index Name]
1-Phenyl-2-(1-pyrrolidinyl)-1-butanon [German] [ACD/IUPAC Name]
1-Phenyl-2-(1-pyrrolidinyl)-1-butanone [ACD/IUPAC Name]
1-Phényl-2-(1-pyrrolidinyl)-1-butanone [French] [ACD/IUPAC Name]
1-phenyl-2-(pyrrolidin-1-yl)butan-1-one
UNII:Y4B3AXV4I4
Y4B3AXV4I4
α-PBP
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 325.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.8±3.0 kJ/mol
Flash Point: 114.8±12.5 °C
Index of Refraction: 1.543
Molar Refractivity: 65.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 0.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.88
ACD/LogD (pH 7.4): 1.89
ACD/BCF (pH 7.4): 8.72
ACD/KOC (pH 7.4): 79.01
Polar Surface Area: 20 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 207.8±3.0 cm3

Click to predict properties on the Chemicalize site


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