ChemSpider 2D Image | 6-Cyano-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid | C9H5N3O2

6-Cyano-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid

  • Molecular FormulaC9H5N3O2
  • Average mass187.155 Da
  • Monoisotopic mass187.038177 Da
  • ChemSpider ID28600519

More details:

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

1190315-88-8 [RN]
1H-Pyrrolo[3,2-b]pyridine-3-carboxylic acid, 6-cyano- [ACD/Index Name]
6-Cyan-1H-pyrrolo[3,2-b]pyridin-3-carbonsäure [German] [ACD/IUPAC Name]
6-Cyano-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid [ACD/IUPAC Name]
Acide 6-cyano-1H-pyrrolo[3,2-b]pyridine-3-carboxylique [French] [ACD/IUPAC Name]
4-methyl-2-(2-nitrophenyl)oxazole
6-cyano-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
6-Cyano-1H-pyrrolo[3,2-b]pyridine-3-carboxylicacid
6-Cyano-4-azaindole-3-carboxylic acid
MFCD12963055 [MDL number]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 538.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 85.8±3.0 kJ/mol
    Flash Point: 279.2±28.7 °C
    Index of Refraction: 1.729
    Molar Refractivity: 46.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.15
    ACD/LogD (pH 5.5): -2.36
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.46
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 90 Å2
    Polarizability: 18.6±0.5 10-24cm3
    Surface Tension: 103.9±5.0 dyne/cm
    Molar Volume: 117.6±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement