Found 37 results

Search term: MF = 'C_{10}H_{4}N_{2}O_{4}'
ChemSpider 2D Image | 5-(Carboxyethynyl)-6-cyanonicotinic acid | C10H4N2O4

5-(Carboxyethynyl)-6-cyanonicotinic acid

  • Molecular FormulaC10H4N2O4
  • Average mass216.150 Da
  • Monoisotopic mass216.017105 Da
  • ChemSpider ID92920043

More details:

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

3-Pyridinecarboxylic acid, 5-(2-carboxyethynyl)-6-cyano- [ACD/Index Name]
5-(Carboxyethinyl)-6-cyannicotinsäure [German] [ACD/IUPAC Name]
5-(Carboxyethynyl)-6-cyanonicotinic acid [ACD/IUPAC Name]
Acide 5-(carboxyéthynyl)-6-cyanonicotinique [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 608.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.0±3.0 kJ/mol
Flash Point: 321.6±31.5 °C
Index of Refraction: 1.673
Molar Refractivity: 48.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.55
ACD/LogD (pH 5.5): -4.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 111 Å2
Polarizability: 19.4±0.5 10-24cm3
Surface Tension: 114.1±5.0 dyne/cm
Molar Volume: 130.6±5.0 cm3

Click to predict properties on the Chemicalize site


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