ChemSpider 2D Image | 5-Bromo-1-[2-(4-methoxy-1-piperidinyl)-2-oxoethyl]-2,4(1H,3H)-pyrimidinedione | C12H16BrN3O4

5-Bromo-1-[2-(4-methoxy-1-piperidinyl)-2-oxoethyl]-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC12H16BrN3O4
  • Average mass346.177 Da
  • Monoisotopic mass345.032410 Da
  • ChemSpider ID30589300

More details:

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

2,4(1H,3H)-Pyrimidinedione, 5-bromo-1-[2-(4-methoxy-1-piperidinyl)-2-oxoethyl]- [ACD/Index Name]
5-Brom-1-[2-(4-methoxy-1-piperidinyl)-2-oxoethyl]-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
5-Bromo-1-[2-(4-methoxy-1-piperidinyl)-2-oxoethyl]-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
5-Bromo-1-[2-(4-méthoxy-1-pipéridinyl)-2-oxoéthyl]-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.611
Molar Refractivity: 74.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.66
ACD/LogD (pH 5.5): -0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 21.61
ACD/LogD (pH 7.4): -0.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.19
Polar Surface Area: 79 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 62.5±5.0 dyne/cm
Molar Volume: 214.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement