ChemSpider 2D Image | 2-(Chloromethyl)-N-(2-methoxybenzyl)-4-quinazolinamine | C17H16ClN3O

2-(Chloromethyl)-N-(2-methoxybenzyl)-4-quinazolinamine

  • Molecular FormulaC17H16ClN3O
  • Average mass313.781 Da
  • Monoisotopic mass313.098175 Da
  • ChemSpider ID26457430

More details:

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

1255147-28-4 [RN]
2-(Chlormethyl)-N-(2-methoxybenzyl)-4-chinazolinamin [German] [ACD/IUPAC Name]
2-(Chloromethyl)-N-(2-methoxybenzyl)-4-quinazolinamine [ACD/IUPAC Name]
2-(Chlorométhyl)-N-(2-méthoxybenzyl)-4-quinazolinamine [French] [ACD/IUPAC Name]
2-(chloromethyl)-N-(2-methoxybenzyl)quinazolin-4-amine
4-Quinazolinamine, 2-(chloromethyl)-N-[(2-methoxyphenyl)methyl]- [ACD/Index Name]
MFCD18064582 [MDL number]
2-(chloromethyl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine
4-quinazolinamine, 2-(chloromethyl)-N-[(2-methoxyphenyl)methyl]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 412.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.5±3.0 kJ/mol
    Flash Point: 203.2±28.7 °C
    Index of Refraction: 1.675
    Molar Refractivity: 90.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.51
    ACD/LogD (pH 5.5): 4.03
    ACD/BCF (pH 5.5): 606.53
    ACD/KOC (pH 5.5): 2998.01
    ACD/LogD (pH 7.4): 4.22
    ACD/BCF (pH 7.4): 953.44
    ACD/KOC (pH 7.4): 4712.74
    Polar Surface Area: 47 Å2
    Polarizability: 36.0±0.5 10-24cm3
    Surface Tension: 56.3±3.0 dyne/cm
    Molar Volume: 241.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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