ChemSpider 2D Image | Methyl 4-amino-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate | C8H8N4O2

Methyl 4-amino-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate

  • Molecular FormulaC8H8N4O2
  • Average mass192.175 Da
  • Monoisotopic mass192.064728 Da
  • ChemSpider ID23345937

More details:

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

126149-77-7 [RN]
4-Amino-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
4-amino-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid methyl ester
7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-amino-, methyl ester [ACD/Index Name]
Methyl 4-amino-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate [ACD/IUPAC Name]
Methyl-4-amino-1H-pyrrolo[2,3-d]pyrimidin-5-carboxylat [German] [ACD/IUPAC Name]
1H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-amino-, methyl ester (9CI)
Chemistry 13079
ethyl 4-amino-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate

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

    Density: 1.5±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.719
    Molar Refractivity: 50.7±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.78
    ACD/LogD (pH 5.5): 0.17
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 27.37
    ACD/LogD (pH 7.4): 0.23
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 31.75
    Polar Surface Area: 94 Å2
    Polarizability: 20.1±0.5 10-24cm3
    Surface Tension: 84.6±3.0 dyne/cm
    Molar Volume: 128.5±3.0 cm3

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