ChemSpider 2D Image | Methyl 3,4-O-Isopropylidene-L-Threonate | C8H14O5

Methyl 3,4-O-Isopropylidene-L-Threonate

  • Molecular FormulaC8H14O5
  • Average mass190.194 Da
  • Monoisotopic mass190.084122 Da
  • ChemSpider ID23076101

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2R)-(2,2-Diméthyl-1,3-dioxolan-4-yl)(hydroxy)acétate de méthyle [French] [ACD/IUPAC Name]
1,3-Dioxolane-4-acetic acid, α-hydroxy-2,2-dimethyl-, methyl ester, (αR)- [ACD/Index Name]
Methyl (2R)-(2,2-dimethyl-1,3-dioxolan-4-yl)(hydroxy)acetate [ACD/IUPAC Name]
Methyl 3,4-O-Isopropylidene-L-Threonate
Methyl-(2R)-(2,2-dimethyl-1,3-dioxolan-4-yl)(hydroxy)acetat [German] [ACD/IUPAC Name]
1212759-44-8 [RN]
methyl (2R)-2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-hydroxyacetate
METHYL3,4-O-ISOPROPYLIDENE-L-THREONATE

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

MFCD00077805 [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: 257.7±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 57.5±6.0 kJ/mol
Flash Point: 97.1±15.3 °C
Index of Refraction: 1.449
Molar Refractivity: 43.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.47
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.53
ACD/KOC (pH 5.5): 47.10
ACD/LogD (pH 7.4): 0.54
ACD/BCF (pH 7.4): 1.53
ACD/KOC (pH 7.4): 47.10
Polar Surface Area: 65 Å2
Polarizability: 17.3±0.5 10-24cm3
Surface Tension: 35.5±3.0 dyne/cm
Molar Volume: 162.3±3.0 cm3

Click to predict properties on the Chemicalize site


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