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Search term: KMOQMXILLUBOJL (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3S)-1-Benzyl-3-phenylpiperazine | C17H20N2

(3S)-1-Benzyl-3-phenylpiperazine

  • Molecular FormulaC17H20N2
  • Average mass252.354 Da
  • Monoisotopic mass252.162643 Da
  • ChemSpider ID27471031

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-1-Benzyl-3-phenylpiperazine [ACD/IUPAC Name]
(S)-1-benzyl-3-phenylpiperazine
502482-38-4 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 386.3±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.5±3.0 kJ/mol
Flash Point: 156.0±16.1 °C
Index of Refraction: 1.584
Molar Refractivity: 79.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.90
ACD/LogD (pH 7.4): 1.89
ACD/BCF (pH 7.4): 8.94
ACD/KOC (pH 7.4): 82.63
Polar Surface Area: 15 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 42.0±3.0 dyne/cm
Molar Volume: 236.0±3.0 cm3

Click to predict properties on the Chemicalize site


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