ChemSpider 2D Image | L-methyl lactoyllactate | C7H12O5

L-methyl lactoyllactate

  • Molecular FormulaC7H12O5
  • Average mass176.167 Da
  • Monoisotopic mass176.068466 Da
  • ChemSpider ID52083870

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-1-Methoxy-1-oxo-2-propanyl (2S)-2-hydroxypropanoate [ACD/IUPAC Name]
(2S)-1-Methoxy-1-oxo-2-propanyl-(2S)-2-hydroxypropanoat [German] [ACD/IUPAC Name]
(2S)-2-Hydroxypropanoate de (2S)-1-méthoxy-1-oxo-2-propanyle [French] [ACD/IUPAC Name]
36395-19-4 [RN]
L-methyl lactoyllactate
Propanoic acid, 2-hydroxy-, (1S)-2-methoxy-1-methyl-2-oxoethyl ester, (2S)- [ACD/Index Name]
METHYL LACTOYLLACTATE, L-

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

B696F3696Z [DBID]
UNII:B696F3696Z [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 252.5±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 56.9±6.0 kJ/mol
Flash Point: 96.9±13.9 °C
Index of Refraction: 1.442
Molar Refractivity: 39.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.03
ACD/LogD (pH 5.5): 0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 32.58
ACD/LogD (pH 7.4): 0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 32.58
Polar Surface Area: 73 Å2
Polarizability: 15.7±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 149.3±3.0 cm3

Click to predict properties on the Chemicalize site


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