ChemSpider 2D Image | Methyl 2-amino-4-isobutyl-5-pyrimidinecarboxylate | C10H15N3O2

Methyl 2-amino-4-isobutyl-5-pyrimidinecarboxylate

  • Molecular FormulaC10H15N3O2
  • Average mass209.245 Da
  • Monoisotopic mass209.116425 Da
  • ChemSpider ID28293762

More details:

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1133115-97-5 [RN]
2-Amino-4-isobutyl-5-pyrimidinecarboxylate de méthyle [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxylic acid, 2-amino-4-(2-methylpropyl)-, methyl ester [ACD/Index Name]
Methyl 2-amino-4-isobutyl-5-pyrimidinecarboxylate [ACD/IUPAC Name]
methyl 2-amino-4-isobutylpyrimidine-5-carboxylate
Methyl-2-amino-4-isobutyl-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]
[1133115-97-5] [RN]
HC-2522
Methyl 2-amino-4-(2-methylpropyl)pyrimidine-5-carboxylate
methyl-2-amino-4-isobutylpyrimidine-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: 1.1±0.1 g/cm3
    Boiling Point: 389.3±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.9±3.0 kJ/mol
    Flash Point: 189.2±28.4 °C
    Index of Refraction: 1.540
    Molar Refractivity: 57.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.17
    ACD/LogD (pH 5.5): 1.85
    ACD/BCF (pH 5.5): 15.11
    ACD/KOC (pH 5.5): 243.04
    ACD/LogD (pH 7.4): 1.86
    ACD/BCF (pH 7.4): 15.12
    ACD/KOC (pH 7.4): 243.22
    Polar Surface Area: 78 Å2
    Polarizability: 22.7±0.5 10-24cm3
    Surface Tension: 48.0±3.0 dyne/cm
    Molar Volume: 182.3±3.0 cm3

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