ChemSpider 2D Image | tert-Butyl 4-(bromomethyl)piperazine-1-carboxylate | C10H19BrN2O2

tert-Butyl 4-(bromomethyl)piperazine-1-carboxylate

  • Molecular FormulaC10H19BrN2O2
  • Average mass279.174 Da
  • Monoisotopic mass278.062988 Da
  • ChemSpider ID21112621

More details:

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

1-Piperazinecarboxylic acid, 4-(bromomethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-(bromomethyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(brommethyl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-(2-Bromomethyl)-1-piperazinecarboxylic acid, 1,1-dimethylethyl ester
4-(Bromométhyl)-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 4-(bromomethyl)piperazine-1-carboxylate
4-(2-BROMOMETHYL)-1-PIPERAZINECARBOXYLIC ACID TERT-BUTYL ESTER
887579-23-9 [RN]
MFCD07367891 [MDL number]

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

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

Density: 1.3±0.0 g/cm3
Boiling Point: 301.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 54.2±0.0 kJ/mol
Flash Point: 136.1±0.0 °C
Index of Refraction: 1.510
Molar Refractivity: 62.8±0.0 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 2.24
ACD/BCF (pH 5.5): 29.19
ACD/KOC (pH 5.5): 385.22
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 30.30
ACD/KOC (pH 7.4): 399.92
Polar Surface Area: 33 Å2
Polarizability: 24.9±0.0 10-24cm3
Surface Tension: 40.0±0.0 dyne/cm
Molar Volume: 210.0±0.0 cm3

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