Found 2941 results

Search term: MF = 'C_{12}H_{17}BrN_{2}O_{2}S'
ChemSpider 2D Image | 3-BROMO-5-[(1-METHANESULFONYLPIPERIDIN-3-YL)METHYL]PYRIDINE | C12H17BrN2O2S

3-BROMO-5-[(1-METHANESULFONYLPIPERIDIN-3-YL)METHYL]PYRIDINE

  • Molecular FormulaC12H17BrN2O2S
  • Average mass333.245 Da
  • Monoisotopic mass332.019409 Da
  • ChemSpider ID29313424

More details:

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

1316221-86-9 [RN]
3-Brom-5-{[1-(methylsulfonyl)-3-piperidinyl]methyl}pyridin [German] [ACD/IUPAC Name]
3-BROMO-5-[(1-METHANESULFONYLPIPERIDIN-3-YL)METHYL]PYRIDINE
3-Bromo-5-{[1-(methylsulfonyl)-3-piperidinyl]methyl}pyridine [ACD/IUPAC Name]
3-Bromo-5-{[1-(méthylsulfonyl)-3-pipéridinyl]méthyl}pyridine [French] [ACD/IUPAC Name]
Pyridine, 3-bromo-5-[[1-(methylsulfonyl)-3-piperidinyl]methyl]- [ACD/Index Name]
3-Bromo-5-((1-(methylsulfonyl)piperidin-3-yl)methyl)pyridine
3-Bromo-5-(1-methanesulfonyl-piperidin-3-ylmethyl)-pyridine
3-bromo-5-[(1-methylsulfonylpiperidin-3-yl)methyl]pyridine
MFCD19691571 [MDL number]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 446.2±48.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.4±3.0 kJ/mol
Flash Point: 223.7±29.6 °C
Index of Refraction: 1.604
Molar Refractivity: 75.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 35.48
ACD/KOC (pH 5.5): 447.28
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 35.62
ACD/KOC (pH 7.4): 449.08
Polar Surface Area: 59 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 58.4±5.0 dyne/cm
Molar Volume: 218.9±5.0 cm3

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