ChemSpider 2D Image | (2Z)-3-(Dimethylamino)-1-(~2~H_5_)phenyl-2-propen-1-one | C11H8D5NO

(2Z)-3-(Dimethylamino)-1-(2H5)phenyl-2-propen-1-one

  • Molecular FormulaC11H8D5NO
  • Average mass180.258 Da
  • Monoisotopic mass180.131104 Da
  • ChemSpider ID77448117

  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope

More details:

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

(2Z)-3-(Dimethylamino)-1-(2H5)phenyl-2-propen-1-on [German] [ACD/IUPAC Name]
(2Z)-3-(Dimethylamino)-1-(2H5)phenyl-2-propen-1-one [ACD/IUPAC Name]
(2Z)-3-(Diméthylamino)-1-(2H5)phényl-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 3-(dimethylamino)-1-(phenyl-d5)-, (2Z)- [ACD/Index Name]
(2Z)-3-(dimethylamino)-1-[(2,3,4,5,6-2H5)phenyl]prop-2-en-1-one
2093014-33-4 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 260.0±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.8±3.0 kJ/mol
Flash Point: 88.8±14.5 °C
Index of Refraction: 1.542
Molar Refractivity: 54.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.30
ACD/LogD (pH 5.5): 1.61
ACD/BCF (pH 5.5): 8.23
ACD/KOC (pH 5.5): 127.65
ACD/LogD (pH 7.4): 1.92
ACD/BCF (pH 7.4): 16.93
ACD/KOC (pH 7.4): 262.61
Polar Surface Area: 20 Å2
Polarizability: 21.4±0.5 10-24cm3
Surface Tension: 37.7±3.0 dyne/cm
Molar Volume: 171.4±3.0 cm3

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