ChemSpider 2D Image | Methyl 2-amino-4-phenyl-5-pyrimidinecarboxylate | C12H11N3O2

Methyl 2-amino-4-phenyl-5-pyrimidinecarboxylate

  • Molecular FormulaC12H11N3O2
  • Average mass229.235 Da
  • Monoisotopic mass229.085129 Da
  • ChemSpider ID28293773

More details:

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

1150163-80-6 [RN]
2-Amino-4-phényl-5-pyrimidinecarboxylate de méthyle [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxylic acid, 2-amino-4-phenyl-, methyl ester [ACD/Index Name]
Methyl 2-amino-4-phenyl-5-pyrimidinecarboxylate [ACD/IUPAC Name]
methyl 2-amino-4-phenylpyrimidine-5-carboxylate
Methyl-2-amino-4-phenyl-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]
[1150163-80-6] [RN]
223423-17-4 [RN]
Methyl 1-Boc-3-methylpiperidine-3-carboxylate
methyl-2-amino-4-phenylpyrimidine-5-carboxylate
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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: 478.4±47.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.2±3.0 kJ/mol
    Flash Point: 243.1±29.3 °C
    Index of Refraction: 1.612
    Molar Refractivity: 63.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.90
    ACD/LogD (pH 5.5): 1.89
    ACD/BCF (pH 5.5): 16.23
    ACD/KOC (pH 5.5): 255.80
    ACD/LogD (pH 7.4): 1.89
    ACD/BCF (pH 7.4): 16.23
    ACD/KOC (pH 7.4): 255.86
    Polar Surface Area: 78 Å2
    Polarizability: 25.0±0.5 10-24cm3
    Surface Tension: 57.6±3.0 dyne/cm
    Molar Volume: 181.3±3.0 cm3

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