ChemSpider 2D Image | Methyl 6-{[(4-methoxyphenyl)methyl]amino}pyridine-3-carboxylate | C15H16N2O3

Methyl 6-{[(4-methoxyphenyl)methyl]amino}pyridine-3-carboxylate

  • Molecular FormulaC15H16N2O3
  • Average mass272.299 Da
  • Monoisotopic mass272.116089 Da
  • ChemSpider ID28294120

More details:

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

1187385-93-8 [RN]
6-[(4-Méthoxybenzyl)amino]nicotinate de méthyle [French] [ACD/IUPAC Name]
Methyl 6-{[(4-methoxyphenyl)methyl]amino}pyridine-3-carboxylate
Methyl-6-[(4-methoxybenzyl)amino]nicotinat [German] [ACD/IUPAC Name]
[1187385-93-8] [RN]
'1187385-93-8 [EINECS]
3-Pyridinecarboxylic acid, 6-[[(4-methoxyphenyl)methyl]amino]-, methyl ester [ACD/Index Name]
5-Amino-2-methylnicotinic acid [ACD/IUPAC Name]
Methyl 6-((4-methoxybenzyl)amino)nicotinate
methyl 6-(4-methoxybenzylamino)nicotinate
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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: 1.2±0.1 g/cm3
    Boiling Point: 422.0±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.6±3.0 kJ/mol
    Flash Point: 209.0±27.3 °C
    Index of Refraction: 1.600
    Molar Refractivity: 76.9±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.27
    ACD/LogD (pH 5.5): 3.42
    ACD/BCF (pH 5.5): 228.54
    ACD/KOC (pH 5.5): 1650.84
    ACD/LogD (pH 7.4): 3.46
    ACD/BCF (pH 7.4): 252.47
    ACD/KOC (pH 7.4): 1823.64
    Polar Surface Area: 60 Å2
    Polarizability: 30.5±0.5 10-24cm3
    Surface Tension: 48.8±3.0 dyne/cm
    Molar Volume: 224.7±3.0 cm3

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