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Search term: JPRFUVVWNBBEDI (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (1R)-2-Benzyl-2,5-diazabicyclo[2.2.1]heptane | C12H16N2

(1R)-2-Benzyl-2,5-diazabicyclo[2.2.1]heptane

  • Molecular FormulaC12H16N2
  • Average mass188.269 Da
  • Monoisotopic mass188.131348 Da
  • ChemSpider ID75679024

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(1R)-2-Benzyl-2,5-diazabicyclo[2.2.1]heptan [German] [ACD/IUPAC Name]
(1R)-2-Benzyl-2,5-diazabicyclo[2.2.1]heptane [ACD/IUPAC Name]
(1R)-2-Benzyl-2,5-diazabicyclo[2.2.1]heptane [French] [ACD/IUPAC Name]
2,5-Diazabicyclo[2.2.1]heptane, 2-(phenylmethyl)-, (1R)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 291.0±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.0±3.0 kJ/mol
Flash Point: 128.1±12.7 °C
Index of Refraction: 1.585
Molar Refractivity: 57.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.21
ACD/LogD (pH 5.5): -1.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 15 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 170.6±3.0 cm3

Click to predict properties on the Chemicalize site


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