Found 350 results

Search term: MF = 'C_{14}H_{11}ClN_{4}O_{4}'
ChemSpider 2D Image | 3-{[4-Chloro-3-(methylcarbamoyl)phenyl]carbamoyl}-2-pyrazinecarboxylic acid | C14H11ClN4O4

3-{[4-Chloro-3-(methylcarbamoyl)phenyl]carbamoyl}-2-pyrazinecarboxylic acid

  • Molecular FormulaC14H11ClN4O4
  • Average mass334.715 Da
  • Monoisotopic mass334.046875 Da
  • ChemSpider ID28473127

More details:

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

2-Pyrazinecarboxylic acid, 3-[[[4-chloro-3-[(methylamino)carbonyl]phenyl]amino]carbonyl]- [ACD/Index Name]
3-{[4-Chlor-3-(methylcarbamoyl)phenyl]carbamoyl}-2-pyrazincarbonsäure [German] [ACD/IUPAC Name]
3-{[4-Chloro-3-(methylcarbamoyl)phenyl]carbamoyl}-2-pyrazinecarboxylic acid [ACD/IUPAC Name]
Acide 3-{[4-chloro-3-(méthylcarbamoyl)phényl]carbamoyl}-2-pyrazinecarboxylique [French] [ACD/IUPAC Name]
1324066-09-2 [RN]
3-[[4-chloro-3-(methylcarbamoyl)phenyl]carbamoyl]pyrazine-2-carboxylic acid
3-{[4-chloro-3-(methylcarbamoyl)phenyl]carbamoyl}pyrazine-2-carboxylic acid

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 497.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 80.5±3.0 kJ/mol
    Flash Point: 254.4±28.7 °C
    Index of Refraction: 1.675
    Molar Refractivity: 82.5±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 3
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -1.13
    ACD/LogD (pH 5.5): -2.71
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.96
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 121 Å2
    Polarizability: 32.7±0.5 10-24cm3
    Surface Tension: 75.1±3.0 dyne/cm
    Molar Volume: 219.6±3.0 cm3

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