Found 2 results

Search term: ADCYRBXQAJXJTD (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-(4-Chlorophenyl)-1-(2-~2~H_1_)propanone | C9H8DClO

1-(4-Chlorophenyl)-1-(2-2H1)propanone

  • Molecular FormulaC9H8DClO
  • Average mass169.626 Da
  • Monoisotopic mass169.040466 Da
  • ChemSpider ID74084695

  • Non-standard isotope - Non-standard isotope

More details:

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

1-(4-Chlorophenyl)-1-(2-2H1)propanone [ACD/IUPAC Name]
1-(4-Chlorophényl)-1-(2-2H1)propanone [French] [ACD/IUPAC Name]
1-(4-Chlorphenyl)-1-(2-2H1)propanon [German] [ACD/IUPAC Name]
1-Propanone-2-d, 1-(4-chlorophenyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 276.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 51.5±3.0 kJ/mol
Flash Point: 123.5±11.0 °C
Index of Refraction: 1.525
Molar Refractivity: 45.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 63.63
ACD/KOC (pH 5.5): 680.27
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 63.63
ACD/KOC (pH 7.4): 680.27
Polar Surface Area: 17 Å2
Polarizability: 18.2±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 149.4±3.0 cm3

Click to predict properties on the Chemicalize site


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