ChemSpider 2D Image | (2R,3R)-2-Hydroxy-3-methoxy-3-phenylpropanoic acid | C10H12O4

(2R,3R)-2-Hydroxy-3-methoxy-3-phenylpropanoic acid

  • Molecular FormulaC10H12O4
  • Average mass196.200 Da
  • Monoisotopic mass196.073563 Da
  • ChemSpider ID35034064

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-2-Hydroxy-3-methoxy-3-phenylpropanoic acid [ACD/IUPAC Name]
(2R,3R)-2-Hydroxy-3-methoxy-3-phenylpropansäure [German] [ACD/IUPAC Name]
Acide (2R,3R)-2-hydroxy-3-méthoxy-3-phénylpropanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, α-hydroxy-β-methoxy-, (αR,βR)- [ACD/Index Name]
M72

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

Density: 1.3±0.1 g/cm3
Boiling Point: 352.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.0±3.0 kJ/mol
Flash Point: 139.8±21.4 °C
Index of Refraction: 1.557
Molar Refractivity: 49.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): -1.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 67 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 154.9±3.0 cm3

Click to predict properties on the Chemicalize site


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