ChemSpider 2D Image | 1-{2-Hydroxy-4-[(~2~H_3_)methyloxy]phenyl}ethanone | C9H7D3O3

1-{2-Hydroxy-4-[(2H3)methyloxy]phenyl}ethanone

  • Molecular FormulaC9H7D3O3
  • Average mass169.192 Da
  • Monoisotopic mass169.081818 Da
  • ChemSpider ID24607003

  • Non-standard isotope - Non-standard isotope

More details:

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

1-{2-Hydroxy-4-[(2H3)methyloxy]phenyl}ethanon [German] [ACD/IUPAC Name]
1-{2-Hydroxy-4-[(2H3)methyloxy]phenyl}ethanone [ACD/IUPAC Name]
1-{2-Hydroxy-4-[(2H3)méthyloxy]phényl}éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[2-hydroxy-4-(methyl-d3-oxy)phenyl]- [ACD/Index Name]
2-HYDROXY-4-DEUTEROMETHOXYACETOPHENONE
2-HYDROXY-4-METHOXYACETOPHENONE (4,4,4-D3)
55712-78-2 [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: 301.9±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.4±3.0 kJ/mol
Flash Point: 122.3±15.8 °C
Index of Refraction: 1.538
Molar Refractivity: 44.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 24.89
ACD/KOC (pH 5.5): 347.43
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 24.79
ACD/KOC (pH 7.4): 346.02
Polar Surface Area: 47 Å2
Polarizability: 17.8±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 143.4±3.0 cm3

Click to predict properties on the Chemicalize site


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