ChemSpider 2D Image | 2-[(4-Cyanophenyl)amino]-4-pyrimidinecarboxylic acid | C12H8N4O2

2-[(4-Cyanophenyl)amino]-4-pyrimidinecarboxylic acid

  • Molecular FormulaC12H8N4O2
  • Average mass240.217 Da
  • Monoisotopic mass240.064728 Da
  • ChemSpider ID28638129

More details:

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

2-[(4-Cyanophenyl)amino]-4-pyrimidinecarboxylic acid [ACD/IUPAC Name]
2-[(4-Cyanphenyl)amino]-4-pyrimidincarbonsäure [German] [ACD/IUPAC Name]
4-Pyrimidinecarboxylic acid, 2-[(4-cyanophenyl)amino]- [ACD/Index Name]
Acide 2-[(4-cyanophényl)amino]-4-pyrimidinecarboxylique [French] [ACD/IUPAC Name]
1393845-75-4 [RN]
2-((4-cyanophenyl)amino)pyrimidine-4-carboxylic acid
2-[(4-Cyanophenyl)amino]pyrimidine-4-carboxylic acid
cyanophenylaminopyrimidinecarboxylicacid
FG-0723
MFCD22383955 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 544.2±56.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 86.6±3.0 kJ/mol
    Flash Point: 282.9±31.8 °C
    Index of Refraction: 1.673
    Molar Refractivity: 61.6±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.53
    ACD/LogD (pH 5.5): -0.63
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.41
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 99 Å2
    Polarizability: 24.4±0.5 10-24cm3
    Surface Tension: 89.5±5.0 dyne/cm
    Molar Volume: 164.2±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement