ChemSpider 2D Image | 2-{[(3S)-1-Benzyl-3-piperidinyl](isopropyl)amino}ethanol | C17H28N2O

2-{[(3S)-1-Benzyl-3-piperidinyl](isopropyl)amino}ethanol

  • Molecular FormulaC17H28N2O
  • Average mass276.417 Da
  • Monoisotopic mass276.220154 Da
  • ChemSpider ID28298182

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1354015-38-5 [RN]
2-{[(3S)-1-Benzyl-3-piperidinyl](isopropyl)amino}ethanol [German] [ACD/IUPAC Name]
2-{[(3S)-1-Benzyl-3-piperidinyl](isopropyl)amino}ethanol [ACD/IUPAC Name]
2-{[(3S)-1-Benzyl-3-pipéridinyl](isopropyl)amino}éthanol [French] [ACD/IUPAC Name]
2-{[(3S)-1-BENZYLPIPERIDIN-3-YL](PROPAN-2-YL)AMINO}ETHAN-1-OL
Ethanol, 2-[(1-methylethyl)[(3S)-1-(phenylmethyl)-3-piperidinyl]amino]- [ACD/Index Name]
(S)-2-((1-Benzylpiperidin-3-yl)(isopropyl)amino)ethanol
2-[((S)-1-benzylpiperidin-3-yl)isopropylamino]ethanol
2-[((S)-1-benzylpiperidin-3-yl)-isopropyl-amino]-ethanol
2-[((S)-1-Benzyl-piperidin-3-yl)-isopropyl-amino]-ethanol
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 396.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.2±3.0 kJ/mol
Flash Point: 175.8±25.2 °C
Index of Refraction: 1.558
Molar Refractivity: 84.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.51
ACD/LogD (pH 5.5): -1.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 27 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 44.6±5.0 dyne/cm
Molar Volume: 263.3±5.0 cm3

Click to predict properties on the Chemicalize site


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