Found 23238 results

Search term: MF = 'C_{16}H_{16}N_{4}O_{2}'
ChemSpider 2D Image | Ethyl 2-[2-(methylamino)-4-pyrimidinyl]-1H-indole-5-carboxylate | C16H16N4O2

Ethyl 2-[2-(methylamino)-4-pyrimidinyl]-1H-indole-5-carboxylate

  • Molecular FormulaC16H16N4O2
  • Average mass296.324 Da
  • Monoisotopic mass296.127319 Da
  • ChemSpider ID28289945

More details:

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

1H-Indole-5-carboxylic acid, 2-[2-(methylamino)-4-pyrimidinyl]-, ethyl ester [ACD/Index Name]
2-[2-(Méthylamino)-4-pyrimidinyl]-1H-indole-5-carboxylate d'éthyle [French] [ACD/IUPAC Name]
916486-06-1 [RN]
Ethyl 2-[2-(methylamino)-4-pyrimidinyl]-1H-indole-5-carboxylate [ACD/IUPAC Name]
ethyl 2-[2-(methylamino)pyrimidin-4-yl]-1H-indole-5-carboxylate
Ethyl-2-[2-(methylamino)-4-pyrimidinyl]-1H-indol-5-carboxylat [German] [ACD/IUPAC Name]
[916486-06-1] [RN]
4-Cyano-3-tetrahydrothiophenone
4-oxotetrahydrothiophene-3-carbonitrile
AGN-PC-0D4HYX
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 552.6±58.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 83.3±3.0 kJ/mol
    Flash Point: 288.0±32.3 °C
    Index of Refraction: 1.674
    Molar Refractivity: 85.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.64
    ACD/LogD (pH 5.5): 3.23
    ACD/BCF (pH 5.5): 159.34
    ACD/KOC (pH 5.5): 1238.44
    ACD/LogD (pH 7.4): 3.32
    ACD/BCF (pH 7.4): 194.83
    ACD/KOC (pH 7.4): 1514.22
    Polar Surface Area: 80 Å2
    Polarizability: 33.8±0.5 10-24cm3
    Surface Tension: 61.1±3.0 dyne/cm
    Molar Volume: 227.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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