ChemSpider 2D Image | O-Benzoyl-L-malic acid | C11H10O6

O-Benzoyl-L-malic acid

  • Molecular FormulaC11H10O6
  • Average mass238.193 Da
  • Monoisotopic mass238.047745 Da
  • ChemSpider ID65061282

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-(Benzoyloxy)bernsteinsäure [German] [ACD/IUPAC Name]
(2S)-2-(Benzoyloxy)succinic acid [ACD/IUPAC Name]
22138-51-8 [RN]
Acide (2S)-2-(benzoyloxy)succinique [French] [ACD/IUPAC Name]
Butanedioic acid, 2-(benzoyloxy)-, (2S)- [ACD/Index Name]
O-Benzoyl-L-malic acid
(2S)-2-benzoyloxybutanedioic acid
Benzoylmalic acid

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

Density: 1.4±0.1 g/cm3
Boiling Point: 433.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.6±3.0 kJ/mol
Flash Point: 171.4±19.4 °C
Index of Refraction: 1.575
Molar Refractivity: 55.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): -2.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 101 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 64.9±3.0 dyne/cm
Molar Volume: 166.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement