ChemSpider 2D Image | 4-(4-Bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylic acid | C12H11BrN2O3

4-(4-Bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylic acid

  • Molecular FormulaC12H11BrN2O3
  • Average mass311.131 Da
  • Monoisotopic mass309.995300 Da
  • ChemSpider ID24765263

More details:

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

4-(4-Bromophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylic acid [ACD/IUPAC Name]
4-(4-Bromphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidincarbonsäure [German] [ACD/IUPAC Name]
5-Pyrimidinecarboxylic acid, 4-(4-bromophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo- [ACD/Index Name]
5-PYRIMIDINECARBOXYLICACID, 4-(4-BROMOPHENYL)-1,2,3,4-TETRAHYDRO-6-METHYL-2-OXO-
891190-54-8 [RN]
Acide 4-(4-bromophényl)-6-méthyl-2-oxo-1,2,3,4-tétrahydro-5-pyrimidinecarboxylique [French] [ACD/IUPAC Name]
1,2,3,4-Tetrahydro-6-methyl-4-(4-bromophenyl)-2-oxo-5-pyrimidinecarboxylic acid
1,2,3,4-Tetrahydro-6-methyl-4-(4-bromophenyl)-2-oxo-5-pyrimidinecarboxylic acid
1,2,3,4-Tetrahydro-6-methyl-4-(4-bromophenyl)-2-oxo-5-pyrimidinecarboxylic?acid
1,2,3,4-Tetrahydro-6-methyl-4-(4-bromophenyl)-2-oxo-5-pyrimidinecarboxylicacid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 446.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.3±3.0 kJ/mol
Flash Point: 224.1±28.7 °C
Index of Refraction: 1.605
Molar Refractivity: 67.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 14.30
ACD/KOC (pH 5.5): 213.29
ACD/LogD (pH 7.4): 0.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.50
Polar Surface Area: 78 Å2
Polarizability: 26.9±0.5 10-24cm3
Surface Tension: 51.5±3.0 dyne/cm
Molar Volume: 196.9±3.0 cm3

Click to predict properties on the Chemicalize site


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