ChemSpider 2D Image | Methyl 3-amino-5-chloropyrazine-2-carboxylate | C6H6ClN3O2

Methyl 3-amino-5-chloropyrazine-2-carboxylate

  • Molecular FormulaC6H6ClN3O2
  • Average mass187.584 Da
  • Monoisotopic mass187.014847 Da
  • ChemSpider ID28534769

More details:

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

28643-16-5 [RN]
Methyl 3-amino-5-chloropyrazine-2-carboxylate
[28643-16-5] [RN]
1000340-39-5 [RN]
2-Pyrazinecarboxylic acid, 3-amino-5-chloro-, methyl ester [ACD/Index Name]
3-Amino-5-chloro-2-pyrazinecarboxylate de méthyle [French] [ACD/IUPAC Name]
3-amino-5-chloro-pyrazine-2-carboxylic acid methyl
3-AMINO-5-CHLORO-PYRAZINE-2-CARBOXYLIC ACID METHYL ESTER
3-amino-5-chloro-pyrazine-2-carboxylicacidmethylester
Methyl 3-amino-5-chloro-2-pyrazinecarboxylate [ACD/IUPAC Name]
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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: 1.5±0.1 g/cm3
    Boiling Point: 323.2±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.5±3.0 kJ/mol
    Flash Point: 149.3±26.5 °C
    Index of Refraction: 1.592
    Molar Refractivity: 43.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.40
    ACD/LogD (pH 5.5): 1.70
    ACD/BCF (pH 5.5): 11.58
    ACD/KOC (pH 5.5): 200.95
    ACD/LogD (pH 7.4): 1.70
    ACD/BCF (pH 7.4): 11.58
    ACD/KOC (pH 7.4): 200.95
    Polar Surface Area: 78 Å2
    Polarizability: 17.2±0.5 10-24cm3
    Surface Tension: 64.0±3.0 dyne/cm
    Molar Volume: 128.0±3.0 cm3

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