ChemSpider 2D Image | 2-(~2~H_3_)Methyl(~2~H_4_)benzoyl chloride | C8D7ClO

2-(2H3)Methyl(2H4)benzoyl chloride

  • Molecular FormulaC8D7ClO
  • Average mass161.637 Da
  • Monoisotopic mass161.062485 Da
  • ChemSpider ID107436781

  • Non-standard isotope - Non-standard isotope

More details:

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

2-(2H3)Methyl(2H4)benzoyl chloride [ACD/IUPAC Name]
2-(2H3)Methyl(2H4)benzoylchlorid [German] [ACD/IUPAC Name]
Benzoyl-2,3,4,5-d4 chloride, 6-(methyl-d3)- [ACD/Index Name]
Chlorure de 2-(2H3)méthyl(2H4)benzoyle [French] [ACD/IUPAC Name]
142179-66-6 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 213.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.0±3.0 kJ/mol
Flash Point: 84.1±11.9 °C
Index of Refraction: 1.538
Molar Refractivity: 41.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.67
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 60.36
ACD/KOC (pH 5.5): 655.03
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 60.36
ACD/KOC (pH 7.4): 655.03
Polar Surface Area: 17 Å2
Polarizability: 16.4±0.5 10-24cm3
Surface Tension: 38.3±3.0 dyne/cm
Molar Volume: 132.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement