ChemSpider 2D Image | Methyl 5-bromo-4-chloro-6-isopropyl-2-pyrimidinecarboxylate | C9H10BrClN2O2

Methyl 5-bromo-4-chloro-6-isopropyl-2-pyrimidinecarboxylate

  • Molecular FormulaC9H10BrClN2O2
  • Average mass293.545 Da
  • Monoisotopic mass291.961395 Da
  • ChemSpider ID49359077

More details:

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

2-Pyrimidinecarboxylic acid, 5-bromo-4-chloro-6-(1-methylethyl)-, methyl ester [ACD/Index Name]
5-Bromo-4-chloro-6-isopropyl-2-pyrimidinecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 5-bromo-4-chloro-6-isopropyl-2-pyrimidinecarboxylate [ACD/IUPAC Name]
Methyl-5-brom-4-chlor-6-isopropyl-2-pyrimidincarboxylat [German] [ACD/IUPAC Name]
1516633-04-7 [RN]
MFCD21743851

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

Density: 1.5±0.1 g/cm3
Boiling Point: 368.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.5±3.0 kJ/mol
Flash Point: 176.7±30.7 °C
Index of Refraction: 1.548
Molar Refractivity: 61.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.28
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 63.06
ACD/KOC (pH 5.5): 675.89
ACD/LogD (pH 7.4): 2.67
ACD/BCF (pH 7.4): 63.06
ACD/KOC (pH 7.4): 675.89
Polar Surface Area: 52 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 192.0±3.0 cm3

Click to predict properties on the Chemicalize site


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