ChemSpider 2D Image | 2-Methyl-1-[4-(~2~H_3_)methylphenyl]-3-(1-piperidinyl)-1-propanone | C16H20D3NO

2-Methyl-1-[4-(2H3)methylphenyl]-3-(1-piperidinyl)-1-propanone

  • Molecular FormulaC16H20D3NO
  • Average mass248.378 Da
  • Monoisotopic mass248.196793 Da
  • ChemSpider ID28529435

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Propanone, 2-methyl-1-[4-(methyl-d3)phenyl]-3-(1-piperidinyl)- [ACD/Index Name]
2-Methyl-1-[4-(2H3)methylphenyl]-3-(1-piperidinyl)-1-propanon [German] [ACD/IUPAC Name]
2-Methyl-1-[4-(2H3)methylphenyl]-3-(1-piperidinyl)-1-propanone [ACD/IUPAC Name]
2-Méthyl-1-[4-(2H3)méthylphényl]-3-(1-pipéridinyl)-1-propanone [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 373.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.1±3.0 kJ/mol
Flash Point: 134.4±12.5 °C
Index of Refraction: 1.526
Molar Refractivity: 75.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 0.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.18
ACD/LogD (pH 7.4): 2.53
ACD/BCF (pH 7.4): 26.66
ACD/KOC (pH 7.4): 177.31
Polar Surface Area: 20 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 37.1±3.0 dyne/cm
Molar Volume: 244.2±3.0 cm3

Click to predict properties on the Chemicalize site


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