ChemSpider 2D Image | 2-Methyl-2-propanyl 4-(bromomethyl)-3,6-dihydro-1(2H)-pyridinecarboxylate | C11H18BrNO2

2-Methyl-2-propanyl 4-(bromomethyl)-3,6-dihydro-1(2H)-pyridinecarboxylate

  • Molecular FormulaC11H18BrNO2
  • Average mass276.170 Da
  • Monoisotopic mass275.052094 Da
  • ChemSpider ID62006999

More details:

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

1(2H)-Pyridinecarboxylic acid, 4-(bromomethyl)-3,6-dihydro-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-(bromomethyl)-3,6-dihydro-1(2H)-pyridinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(brommethyl)-3,6-dihydro-1(2H)-pyridincarboxylat [German] [ACD/IUPAC Name]
4-(Bromométhyl)-3,6-dihydro-1(2H)-pyridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1,1-Dimethylethyl 4-(bromomethyl)-3,6-dihydro-1(2H)-pyridinecarboxylate
1352724-25-4 [RN]
MFCD32203471
tert-butyl 4-(bromomethyl)-1,2,3,6-tetrahydropyridine-1-carboxylate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 301.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.2±3.0 kJ/mol
Flash Point: 136.2±27.9 °C
Index of Refraction: 1.516
Molar Refractivity: 63.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.70
ACD/LogD (pH 5.5): 3.07
ACD/BCF (pH 5.5): 126.56
ACD/KOC (pH 5.5): 1112.83
ACD/LogD (pH 7.4): 3.07
ACD/BCF (pH 7.4): 126.56
ACD/KOC (pH 7.4): 1112.83
Polar Surface Area: 30 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 210.2±3.0 cm3

Click to predict properties on the Chemicalize site


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