ChemSpider 2D Image | (4-Bromo-1-methyl-1H-pyrrol-2-yl)[4-(1-methoxy-2-propanyl)-1-piperazinyl]methanone | C14H22BrN3O2

(4-Bromo-1-methyl-1H-pyrrol-2-yl)[4-(1-methoxy-2-propanyl)-1-piperazinyl]methanone

  • Molecular FormulaC14H22BrN3O2
  • Average mass344.247 Da
  • Monoisotopic mass343.089539 Da
  • ChemSpider ID30462606

More details:

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

(4-Brom-1-methyl-1H-pyrrol-2-yl)[4-(1-methoxy-2-propanyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
(4-Bromo-1-methyl-1H-pyrrol-2-yl)[4-(1-methoxy-2-propanyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
(4-Bromo-1-méthyl-1H-pyrrol-2-yl)[4-(1-méthoxy-2-propanyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (4-bromo-1-methyl-1H-pyrrol-2-yl)[4-(2-methoxy-1-methylethyl)-1-piperazinyl]- [ACD/Index Name]
1-(4-BROMO-1-METHYL-1H-PYRROLE-2-CARBONYL)-4-(1-METHOXYPROPAN-2-YL)PIPERAZINE
1-(4-BROMO-1-METHYLPYRROLE-2-CARBONYL)-4-(1-METHOXYPROPAN-2-YL)PIPERAZINE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 443.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.1±3.0 kJ/mol
Flash Point: 221.9±28.7 °C
Index of Refraction: 1.587
Molar Refractivity: 83.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.04
ACD/LogD (pH 5.5): 0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.77
ACD/LogD (pH 7.4): 1.27
ACD/BCF (pH 7.4): 5.40
ACD/KOC (pH 7.4): 114.29
Polar Surface Area: 38 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 43.2±7.0 dyne/cm
Molar Volume: 247.1±7.0 cm3

Click to predict properties on the Chemicalize site


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