ChemSpider 2D Image | Diethyl (3S)-2'-amino-6'-(2-ethoxy-2-oxoethyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate | C22H24N2O8

Diethyl (3S)-2'-amino-6'-(2-ethoxy-2-oxoethyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate

  • Molecular FormulaC22H24N2O8
  • Average mass444.435 Da
  • Monoisotopic mass444.153259 Da
  • ChemSpider ID22851130

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-2'-Amino-6'-(2-éthoxy-2-oxoéthyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate de diéthyle [French] [ACD/IUPAC Name]
Diethyl (3S)-2'-amino-6'-(2-ethoxy-2-oxoethyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate [ACD/IUPAC Name]
Diethyl-(3S)-2'-amino-6'-(2-ethoxy-2-oxoethyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylat [German] [ACD/IUPAC Name]
Spiro[3H-indole-3,4'-[4H]pyran]-3',5'-dicarboxylic acid, 2'-amino-6'-(2-ethoxy-2-oxoethyl)-1,2-dihydro-2-oxo-, diethyl ester, (3S)- [ACD/Index Name]
(S)-diethyl 2'-amino-6'-(2-ethoxy-2-oxoethyl)-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate
1212383-14-6 [RN]
diethyl (3S)-2'-amino-6'-(2-ethoxy-2-oxoethyl)-2-oxospiro[1H-indole-3,4'-pyran]-3',5'-dicarboxylate

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 656.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 96.6±3.0 kJ/mol
    Flash Point: 350.6±31.5 °C
    Index of Refraction: 1.599
    Molar Refractivity: 110.4±0.4 cm3
    #H bond acceptors: 10
    #H bond donors: 3
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 1
    ACD/LogP: 4.02
    ACD/LogD (pH 5.5): 2.95
    ACD/BCF (pH 5.5): 103.40
    ACD/KOC (pH 5.5): 962.92
    ACD/LogD (pH 7.4): 2.95
    ACD/BCF (pH 7.4): 103.30
    ACD/KOC (pH 7.4): 962.03
    Polar Surface Area: 143 Å2
    Polarizability: 43.8±0.5 10-24cm3
    Surface Tension: 60.5±5.0 dyne/cm
    Molar Volume: 322.9±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement