ChemSpider 2D Image | 5-bromo-2-(2-methylsulfonylethylamino)pyridine-3-carbonitrile | C9H10BrN3O2S

5-bromo-2-(2-methylsulfonylethylamino)pyridine-3-carbonitrile

  • Molecular FormulaC9H10BrN3O2S
  • Average mass304.164 Da
  • Monoisotopic mass302.967712 Da
  • ChemSpider ID26529455

More details:

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

1356065-79-6 [RN]
2-(2-(methylsulfonyl)ethylamino)-5-bromopyridine-3-carbonitrile
3-Pyridinecarbonitrile, 5-bromo-2-[[2-(methylsulfonyl)ethyl]amino]- [ACD/Index Name]
5-Brom-2-{[2-(methylsulfonyl)ethyl]amino}nicotinonitril [German] [ACD/IUPAC Name]
5-BROMO-2-[(2-METHANESULFONYLETHYL)AMINO]PYRIDINE-3-CARBONITRILE
5-Bromo-2-{[2-(methylsulfonyl)ethyl]amino}nicotinonitrile [ACD/IUPAC Name]
5-Bromo-2-{[2-(méthylsulfonyl)éthyl]amino}nicotinonitrile [French] [ACD/IUPAC Name]
MFCD21605056

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

Density: 1.7±0.1 g/cm3
Boiling Point: 518.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.1±3.0 kJ/mol
Flash Point: 267.4±30.1 °C
Index of Refraction: 1.609
Molar Refractivity: 63.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.05
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 3.92
ACD/KOC (pH 5.5): 92.59
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 3.92
ACD/KOC (pH 7.4): 92.59
Polar Surface Area: 91 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 68.9±5.0 dyne/cm
Molar Volume: 182.6±5.0 cm3

Click to predict properties on the Chemicalize site


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