ChemSpider 2D Image | 2-Bromo-5-((1-(methylsulfonyl)piperidin-4-yl)methyl)pyrazine | C11H16BrN3O2S

2-Bromo-5-((1-(methylsulfonyl)piperidin-4-yl)methyl)pyrazine

  • Molecular FormulaC11H16BrN3O2S
  • Average mass334.233 Da
  • Monoisotopic mass333.014648 Da
  • ChemSpider ID29313400

More details:

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

1316221-87-0 [RN]
2-Brom-5-{[1-(methylsulfonyl)-4-piperidinyl]methyl}pyrazin [German] [ACD/IUPAC Name]
2-Bromo-5-((1-(methylsulfonyl)piperidin-4-yl)methyl)pyrazine
2-Bromo-5-{[1-(methylsulfonyl)-4-piperidinyl]methyl}pyrazine [ACD/IUPAC Name]
2-Bromo-5-{[1-(méthylsulfonyl)-4-pipéridinyl]méthyl}pyrazine [French] [ACD/IUPAC Name]
Pyrazine, 2-bromo-5-[[1-(methylsulfonyl)-4-piperidinyl]methyl]- [ACD/Index Name]
2-Bromo-5-(1-methanesulfonyl-piperidin-4-ylmethyl)-pyrazine
2-BROMO-5-[(1-METHANESULFONYLPIPERIDIN-4-YL)METHYL]PYRAZINE
2-bromo-5-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrazine
MFCD19691556 [MDL number]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 444.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 222.6±31.5 °C
Index of Refraction: 1.607
Molar Refractivity: 73.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.38
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 8.69
ACD/KOC (pH 5.5): 163.52
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 8.69
ACD/KOC (pH 7.4): 163.52
Polar Surface Area: 72 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 64.7±5.0 dyne/cm
Molar Volume: 211.8±5.0 cm3

Click to predict properties on the Chemicalize site


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