ChemSpider 2D Image | 4-(4-Hydroxyphenyl)-2-(1,1,1,3,3-~2~H_5_)butanone | C10H7D5O2

4-(4-Hydroxyphenyl)-2-(1,1,1,3,3-2H5)butanone

  • Molecular FormulaC10H7D5O2
  • Average mass169.232 Da
  • Monoisotopic mass169.115112 Da
  • ChemSpider ID28562384

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Butanone-1,1,1,3,3-d5, 4-(4-hydroxyphenyl)- [ACD/Index Name]
4-(4-Hydroxyphenyl)-2-(1,1,1,3,3-2H5)butanon [German] [ACD/IUPAC Name]
4-(4-Hydroxyphenyl)-2-(1,1,1,3,3-2H5)butanone [ACD/IUPAC Name]
4-(4-Hydroxyphényl)-2-(1,1,1,3,3-2H5)butanone [French] [ACD/IUPAC Name]
1,1,1,3,3-pentadeuterio-4-(4-hydroxyphenyl)butan-2-one
182219-43-8 [RN]
2-Butanone-1,1,1,3,3-d5, 4-(4-hydroxyphenyl)- (9CI)
4-(4-Hydroxyphenyl)(1,1,1,3,3-2H5)butan-2-one
4-(4'-HYDROXYPHENYL)-2-BUTANONE-D5

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

Density: 1.1±0.1 g/cm3
Boiling Point: 292.2±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 55.3±3.0 kJ/mol
Flash Point: 122.9±13.0 °C
Index of Refraction: 1.535
Molar Refractivity: 47.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.94
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 7.12
ACD/KOC (pH 5.5): 141.91
ACD/LogD (pH 7.4): 1.42
ACD/BCF (pH 7.4): 7.11
ACD/KOC (pH 7.4): 141.55
Polar Surface Area: 37 Å2
Polarizability: 18.6±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 150.8±3.0 cm3

Click to predict properties on the Chemicalize site


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