ChemSpider 2D Image | (2R)-Phenyl{[(2R)-1-phenyl-2-propanyl]amino}acetonitrile | C17H18N2

(2R)-Phenyl{[(2R)-1-phenyl-2-propanyl]amino}acetonitrile

  • Molecular FormulaC17H18N2
  • Average mass250.338 Da
  • Monoisotopic mass250.147003 Da
  • ChemSpider ID59700650
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(2R)-Phenyl{[(2R)-1-phenyl-2-propanyl]amino}acetonitril [German] [ACD/IUPAC Name]
(2R)-Phenyl{[(2R)-1-phenyl-2-propanyl]amino}acetonitrile [ACD/IUPAC Name]
(2R)-Phényl{[(2R)-1-phényl-2-propanyl]amino}acétonitrile [French] [ACD/IUPAC Name]
Benzeneacetonitrile, α-[[(1R)-1-methyl-2-phenylethyl]amino]-, (αR)- [ACD/Index Name]
Amphetaminil

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

Density: 1.1±0.1 g/cm3
Boiling Point: 405.2±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.7±3.0 kJ/mol
Flash Point: 198.8±24.6 °C
Index of Refraction: 1.573
Molar Refractivity: 77.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 223.70
ACD/KOC (pH 5.5): 1669.23
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 225.47
ACD/KOC (pH 7.4): 1682.41
Polar Surface Area: 36 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 44.1±3.0 dyne/cm
Molar Volume: 235.8±3.0 cm3

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