Found 3 results

Search term: OBEQVSYPZVGBHL (Found by InChIKey (skeleton match))
ChemSpider 2D Image | tert-butyl (4S)-4-acetyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate | C12H21NO4

tert-butyl (4S)-4-acetyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

  • Molecular FormulaC12H21NO4
  • Average mass243.299 Da
  • Monoisotopic mass243.147064 Da
  • ChemSpider ID24731481

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-4-Acétyl-2,2-diméthyl-1,3-oxazolidine-3-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (4S)-4-acetyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(4S)-4-acetyl-2,2-dimethyl-1,3-oxazolidin-3-carboxylat [German] [ACD/IUPAC Name]
3-Oxazolidinecarboxylic acid, 4-acetyl-2,2-dimethyl-, 1,1-dimethylethyl ester, (4S)- [ACD/Index Name]
785828-28-6 [RN]
tert-butyl (4S)-4-acetyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
(S)-t-Butyl 4-acetyl-2,2-dimethyloxazolidine-3-carboxylate
(S)-TERT-BUTYL 4-ACETYL-2,2-DIMETHYLOXAZOLIDINE-3-CARBOXYLATE
MFCD26406815

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 318.5±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.0±3.0 kJ/mol
    Flash Point: 146.4±27.9 °C
    Index of Refraction: 1.460
    Molar Refractivity: 62.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.23
    ACD/LogD (pH 5.5): 1.26
    ACD/BCF (pH 5.5): 5.37
    ACD/KOC (pH 5.5): 115.88
    ACD/LogD (pH 7.4): 1.26
    ACD/BCF (pH 7.4): 5.37
    ACD/KOC (pH 7.4): 115.88
    Polar Surface Area: 56 Å2
    Polarizability: 24.7±0.5 10-24cm3
    Surface Tension: 33.8±3.0 dyne/cm
    Molar Volume: 227.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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