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Search term: PQQRBNAMXNZVAL (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 2-Hydroxy-3-methoxy-3-oxopropanoic acid | C4H6O5

2-Hydroxy-3-methoxy-3-oxopropanoic acid

  • Molecular FormulaC4H6O5
  • Average mass134.087 Da
  • Monoisotopic mass134.021530 Da
  • ChemSpider ID45403142

More details:






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

2-Hydroxy-3-methoxy-3-oxopropanoic acid [ACD/IUPAC Name]
2-Hydroxy-3-methoxy-3-oxopropansäure [German] [ACD/IUPAC Name]
Acide 2-hydroxy-3-méthoxy-3-oxopropanoïque [French] [ACD/IUPAC Name]
Propanedioic acid, 2-hydroxy-, monomethyl ester [ACD/Index Name]
60787-27-1 [RN]
Carbomethoxy-glykols??ure

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 312.2±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.1±6.0 kJ/mol
Flash Point: 141.2±17.2 °C
Index of Refraction: 1.473
Molar Refractivity: 25.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.37
ACD/LogD (pH 5.5): -4.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 10.1±0.5 10-24cm3
Surface Tension: 59.9±3.0 dyne/cm
Molar Volume: 90.6±3.0 cm3

Click to predict properties on the Chemicalize site






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