Found 40 results

Search term: MF = 'C_{6}H_{2}ClN_{3}O_{2}'
ChemSpider 2D Image | 2-Chloro-5-cyano-4-pyrimidinecarboxylic acid | C6H2ClN3O2

2-Chloro-5-cyano-4-pyrimidinecarboxylic acid

  • Molecular FormulaC6H2ClN3O2
  • Average mass183.552 Da
  • Monoisotopic mass182.983551 Da
  • ChemSpider ID45603616

More details:

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

1784083-82-4 [RN]
2-Chlor-5-cyan-4-pyrimidincarbonsäure [German] [ACD/IUPAC Name]
2-Chloro-5-cyano-4-pyrimidinecarboxylic acid [ACD/IUPAC Name]
2-chloro-5-cyanopyrimidine-4-carboxylic acid
4-Pyrimidinecarboxylic acid, 2-chloro-5-cyano- [ACD/Index Name]
Acide 2-chloro-5-cyano-4-pyrimidinecarboxylique [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: 502.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.3±3.0 kJ/mol
Flash Point: 257.8±25.9 °C
Index of Refraction: 1.622
Molar Refractivity: 38.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.97
ACD/LogD (pH 5.5): -2.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 100.4±5.0 dyne/cm
Molar Volume: 107.9±5.0 cm3

Click to predict properties on the Chemicalize site


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