ChemSpider 2D Image | 2-[2-Chloro(~2~H_4_)phenyl]-2-(methylamino)cyclohexanone | C13H12D4ClNO

2-[2-Chloro(2H4)phenyl]-2-(methylamino)cyclohexanone

  • Molecular FormulaC13H12D4ClNO
  • Average mass241.750 Da
  • Monoisotopic mass241.117142 Da
  • ChemSpider ID78333872

  • Non-standard isotope - Non-standard isotope

More details:

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

2-[2-Chlor(2H4)phenyl]-2-(methylamino)cyclohexanon [German] [ACD/IUPAC Name]
2-[2-Chloro(2H4)phenyl]-2-(methylamino)cyclohexanone [ACD/IUPAC Name]
2-[2-Chloro(2H4)phényl]-2-(méthylamino)cyclohexanone [French] [ACD/IUPAC Name]
Cyclohexanone, 2-(6-chlorophenyl-2,3,4,5-d4)-2-(methylamino)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 363.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.0±3.0 kJ/mol
Flash Point: 173.8±27.9 °C
Index of Refraction: 1.562
Molar Refractivity: 65.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.18
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 2.40
ACD/KOC (pH 5.5): 33.81
ACD/LogD (pH 7.4): 2.07
ACD/BCF (pH 7.4): 21.51
ACD/KOC (pH 7.4): 303.55
Polar Surface Area: 29 Å2
Polarizability: 26.1±0.5 10-24cm3
Surface Tension: 43.9±5.0 dyne/cm
Molar Volume: 202.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement