Found 678 results

Search term: MF = 'C_{13}H_{8}N_{2}O_{3}S'
ChemSpider 2D Image | 5-Oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylic acid | C13H8N2O3S

5-Oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylic acid

  • Molecular FormulaC13H8N2O3S
  • Average mass272.279 Da
  • Monoisotopic mass272.025574 Da
  • ChemSpider ID23646211

More details:

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

446829-29-4 [RN]
5H-Thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 5-oxo-3-phenyl- [ACD/Index Name]
5-Oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-6-carbonsäure [German] [ACD/IUPAC Name]
5-Oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylic acid [ACD/IUPAC Name]
Acide 5-oxo-3-phényl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylique [French] [ACD/IUPAC Name]
5-oxo-3-phenyl-5H-pyrimido[2,1-b][1,3]thiazole-6-carboxylic acid
MFCD03011515 [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: 486.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.2±3.0 kJ/mol
Flash Point: 247.9±31.5 °C
Index of Refraction: 1.744
Molar Refractivity: 72.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.76
ACD/LogD (pH 5.5): -2.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Polarizability: 28.6±0.5 10-24cm3
Surface Tension: 68.2±7.0 dyne/cm
Molar Volume: 178.2±7.0 cm3

Click to predict properties on the Chemicalize site


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