ChemSpider 2D Image | (2S)-1-(Dimethylamino)-3-(1-piperazinyl)-2-propanol | C9H21N3O

(2S)-1-(Dimethylamino)-3-(1-piperazinyl)-2-propanol

  • Molecular FormulaC9H21N3O
  • Average mass187.283 Da
  • Monoisotopic mass187.168457 Da
  • ChemSpider ID113057533

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(Dimethylamino)-3-(1-piperazinyl)-2-propanol [German] [ACD/IUPAC Name]
(2S)-1-(Dimethylamino)-3-(1-piperazinyl)-2-propanol [ACD/IUPAC Name]
(2S)-1-(Diméthylamino)-3-(1-pipérazinyl)-2-propanol [French] [ACD/IUPAC Name]
1-Piperazineethanol, α-[(dimethylamino)methyl]-, (αS)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 278.0±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 60.0±6.0 kJ/mol
Flash Point: 122.0±24.3 °C
Index of Refraction: 1.491
Molar Refractivity: 53.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.29
ACD/LogD (pH 5.5): -4.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 39 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 36.6±3.0 dyne/cm
Molar Volume: 185.8±3.0 cm3

Click to predict properties on the Chemicalize site


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