ChemSpider 2D Image | Methyl 5-bromo-2-pyrimidinecarboxylate | C6H5BrN2O2

Methyl 5-bromo-2-pyrimidinecarboxylate

  • Molecular FormulaC6H5BrN2O2
  • Average mass217.020 Da
  • Monoisotopic mass215.953430 Da
  • ChemSpider ID21499827

More details:

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

2-Pyrimidinecarboxylic acid, 5-bromo-, methyl ester [ACD/Index Name]
5-Bromo-2-pyrimidinecarboxylate de méthyle [French] [ACD/IUPAC Name]
89581-38-4 [RN]
Methyl 5-bromo-2-pyrimidinecarboxylate [ACD/IUPAC Name]
Methyl 5-Bromopyrimidine-2-carboxylate
Methyl-5-brom-2-pyrimidincarboxylat [German] [ACD/IUPAC Name]
[89581-38-4] [RN]
29682-15-3 [RN]
2-Pyrimidinecarboxylicacid, 5-bromo-, methyl ester
5-Bromo-2-(methoxycarbonyl)-1,3-diazine
More...

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

CCRIS 4693 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 314.4±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.6±3.0 kJ/mol
Flash Point: 143.9±25.7 °C
Index of Refraction: 1.558
Molar Refractivity: 41.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.22
ACD/LogD (pH 5.5): 0.44
ACD/BCF (pH 5.5): 1.27
ACD/KOC (pH 5.5): 41.37
ACD/LogD (pH 7.4): 0.44
ACD/BCF (pH 7.4): 1.27
ACD/KOC (pH 7.4): 41.37
Polar Surface Area: 52 Å2
Polarizability: 16.6±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 130.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement