Found 1 result

Search term: 78441223 (Found by CSID)
ChemSpider 2D Image | 2-(4-Hydroxyphenyl)ethyl (3R)-3-hydroxy-3-(4-hydroxyphenyl)propanoate | C17H18O5

2-(4-Hydroxyphenyl)ethyl (3R)-3-hydroxy-3-(4-hydroxyphenyl)propanoate

  • Molecular FormulaC17H18O5
  • Average mass302.322 Da
  • Monoisotopic mass302.115417 Da
  • ChemSpider ID78441223

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-Hydroxy-3-(4-hydroxyphényl)propanoate de 2-(4-hydroxyphényl)éthyle [French] [ACD/IUPAC Name]
2-(4-Hydroxyphenyl)ethyl (3R)-3-hydroxy-3-(4-hydroxyphenyl)propanoate [ACD/IUPAC Name]
2-(4-Hydroxyphenyl)ethyl-(3R)-3-hydroxy-3-(4-hydroxyphenyl)propanoat [German] [ACD/IUPAC Name]
Benzenepropanoic acid, β,4-dihydroxy-, 2-(4-hydroxyphenyl)ethyl ester, (βR)- [ACD/Index Name]
hypocrol A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 531.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 196.1±22.2 °C
Index of Refraction: 1.621
Molar Refractivity: 81.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.61
ACD/KOC (pH 5.5): 237.27
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 14.52
ACD/KOC (pH 7.4): 235.81
Polar Surface Area: 87 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 60.9±3.0 dyne/cm
Molar Volume: 231.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement