ChemSpider 2D Image | (2S,3R)-2-(Carboxymethoxy)-3-hydroxysuccinic acid | C6H8O8

(2S,3R)-2-(Carboxymethoxy)-3-hydroxysuccinic acid

  • Molecular FormulaC6H8O8
  • Average mass208.123 Da
  • Monoisotopic mass208.021912 Da
  • ChemSpider ID25052338

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,3R)-2-(Carboxymethoxy)-3-hydroxybernsteinsäure [German] [ACD/IUPAC Name]
(2S,3R)-2-(Carboxymethoxy)-3-hydroxysuccinic acid [ACD/IUPAC Name]
Acide (2S,3R)-2-(carboxyméthoxy)-3-hydroxysuccinique [French] [ACD/IUPAC Name]
Butanedioic acid, 2-(carboxymethoxy)-3-hydroxy-, (2S,3R)- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 579.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 99.6±6.0 kJ/mol
Flash Point: 242.9±23.6 °C
Index of Refraction: 1.564
Molar Refractivity: 37.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -1.00
ACD/LogD (pH 5.5): -6.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 141 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 100.4±3.0 dyne/cm
Molar Volume: 116.1±3.0 cm3

Click to predict properties on the Chemicalize site


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