ChemSpider 2D Image | 7-Chloro[1,3]oxazolo[5,4-d]pyrimidine-2-carboxylic acid | C6H2ClN3O3

7-Chloro[1,3]oxazolo[5,4-d]pyrimidine-2-carboxylic acid

  • Molecular FormulaC6H2ClN3O3
  • Average mass199.551 Da
  • Monoisotopic mass198.978470 Da
  • ChemSpider ID98512013

More details:

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

7-Chlor[1,3]oxazolo[5,4-d]pyrimidin-2-carbonsäure [German] [ACD/IUPAC Name]
7-Chloro[1,3]oxazolo[5,4-d]pyrimidine-2-carboxylic acid [ACD/IUPAC Name]
Acide 7-chloro[1,3]oxazolo[5,4-d]pyrimidine-2-carboxylique [French] [ACD/IUPAC Name]
Oxazolo[5,4-d]pyrimidine-2-carboxylic acid, 7-chloro- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 427.4±48.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.9±3.0 kJ/mol
Flash Point: 212.3±29.6 °C
Index of Refraction: 1.695
Molar Refractivity: 42.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.46
ACD/LogD (pH 5.5): -2.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 16.8±0.5 10-24cm3
Surface Tension: 95.6±3.0 dyne/cm
Molar Volume: 110.5±3.0 cm3

Click to predict properties on the Chemicalize site


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