ChemSpider 2D Image | O6-[4-(Aminomethyl)benzyl]guanine | C13H14N6O

O6-[4-(Aminomethyl)benzyl]guanine

  • Molecular FormulaC13H14N6O
  • Average mass270.290 Da
  • Monoisotopic mass270.122894 Da
  • ChemSpider ID21588174

More details:

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

6-{[4-(Aminomethyl)benzyl]oxy}-3H-purin-2-amin [German] [ACD/IUPAC Name]
6-{[4-(Aminomethyl)benzyl]oxy}-3H-purin-2-amine [ACD/IUPAC Name]
6-{[4-(Aminométhyl)benzyl]oxy}-3H-purin-2-amine [French] [ACD/IUPAC Name]
674799-96-3 [RN]
7H-Purin-2-amine, 6-[[4-(aminomethyl)phenyl]methoxy]- [ACD/Index Name]
O6-[4-(Aminomethyl)benzyl]guanine
[674799-96-3] [RN]
1H-Purin-2-amine, 6-[[4-(aminomethyl)phenyl]methoxy]-
6-((4-(Aminomethyl)benzyl)oxy)-7H-purin-2-amine
6-((4-(aminomethyl)benzyl)oxy)-9H-purin-2-amine
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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: 1.4±0.1 g/cm3
    Boiling Point: 669.9±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 98.4±3.0 kJ/mol
    Flash Point: 359.0±34.3 °C
    Index of Refraction: 1.748
    Molar Refractivity: 76.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 5
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 1
    ACD/LogP: 0.82
    ACD/LogD (pH 5.5): -2.42
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.04
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.23
    Polar Surface Area: 116 Å2
    Polarizability: 30.4±0.5 10-24cm3
    Surface Tension: 85.7±3.0 dyne/cm
    Molar Volume: 188.5±3.0 cm3

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