ChemSpider 2D Image | (2R,5S)-1,2,5-Trimethylpiperazine | C7H16N2

(2R,5S)-1,2,5-Trimethylpiperazine

  • Molecular FormulaC7H16N2
  • Average mass128.215 Da
  • Monoisotopic mass128.131348 Da
  • ChemSpider ID23499486

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,5S)-1,2,5-Trimethylpiperazine [ACD/IUPAC Name]
1046788-78-6 [RN]
24779-49-5 [RN]
(2R,5S)-1,2,5-Trimethyl-piperazine
(2R,5S)-1,2,5-Trimethylpiperazine oxalate
(2S,5R)-1,2,5-Trimethylpiperazine [ACD/IUPAC Name]
3777-11-5 [RN]
MFCD12755750
MFCD20926310
MFCD26959165 [MDL number]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 0.8±0.1 g/cm3
    Boiling Point: 157.9±8.0 °C at 760 mmHg
    Vapour Pressure: 2.7±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 39.5±3.0 kJ/mol
    Flash Point: 44.0±9.4 °C
    Index of Refraction: 1.428
    Molar Refractivity: 39.5±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.80
    ACD/LogD (pH 5.5): -2.30
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.34
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 15 Å2
    Polarizability: 15.7±0.5 10-24cm3
    Surface Tension: 21.7±3.0 dyne/cm
    Molar Volume: 153.5±3.0 cm3

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