ChemSpider 2D Image | [(2R)-1-(3-Bromo-5-nitro-2-pyridinyl)-2-pyrrolidinyl]methanol | C10H12BrN3O3

[(2R)-1-(3-Bromo-5-nitro-2-pyridinyl)-2-pyrrolidinyl]methanol

  • Molecular FormulaC10H12BrN3O3
  • Average mass302.125 Da
  • Monoisotopic mass301.006195 Da
  • ChemSpider ID30279982

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(2R)-1-(3-Brom-5-nitro-2-pyridinyl)-2-pyrrolidinyl]methanol [German] [ACD/IUPAC Name]
[(2R)-1-(3-Bromo-5-nitro-2-pyridinyl)-2-pyrrolidinyl]methanol [ACD/IUPAC Name]
[(2R)-1-(3-Bromo-5-nitro-2-pyridinyl)-2-pyrrolidinyl]méthanol [French] [ACD/IUPAC Name]
2-Pyrrolidinemethanol, 1-(3-bromo-5-nitro-2-pyridinyl)-, (2R)- [ACD/Index Name]
[(2R)-1-(3-BROMO-5-NITROPYRIDIN-2-YL)PYRROLIDIN-2-YL]METHANOL

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

Density: 1.6±0.1 g/cm3
Boiling Point: 453.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.1±3.0 kJ/mol
Flash Point: 228.0±28.7 °C
Index of Refraction: 1.625
Molar Refractivity: 65.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.03
ACD/LogD (pH 5.5): 2.07
ACD/BCF (pH 5.5): 22.12
ACD/KOC (pH 5.5): 319.27
ACD/LogD (pH 7.4): 2.07
ACD/BCF (pH 7.4): 22.12
ACD/KOC (pH 7.4): 319.27
Polar Surface Area: 82 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 63.8±3.0 dyne/cm
Molar Volume: 183.8±3.0 cm3

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