ChemSpider 2D Image | 2-Hydroxy-3-(4-hydroxyphenyl)(~2~H_3_)propanoic acid | C9H7D3O4

2-Hydroxy-3-(4-hydroxyphenyl)(2H3)propanoic acid

  • Molecular FormulaC9H7D3O4
  • Average mass185.192 Da
  • Monoisotopic mass185.076736 Da
  • ChemSpider ID77494348

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Hydroxy-3-(4-hydroxyphenyl)(2H3)propanoic acid [ACD/IUPAC Name]
2-Hydroxy-3-(4-hydroxyphenyl)(2H3)propansäure [German] [ACD/IUPAC Name]
Acide 2-hydroxy-3-(4-hydroxyphényl)(2H3)propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic-d3 acid, α,4-dihydroxy- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 414.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.4±3.0 kJ/mol
Flash Point: 218.6±21.1 °C
Index of Refraction: 1.617
Molar Refractivity: 45.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.31
ACD/LogD (pH 5.5): -1.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 78 Å2
Polarizability: 18.0±0.5 10-24cm3
Surface Tension: 69.6±3.0 dyne/cm
Molar Volume: 129.7±3.0 cm3

Click to predict properties on the Chemicalize site


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