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Search term: SJYRIEHMQRIBEN-QMMMGPOBSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2-[(1S)-1-Aminopropyl]phenol | C9H13NO

2-[(1S)-1-Aminopropyl]phenol

  • Molecular FormulaC9H13NO
  • Average mass151.206 Da
  • Monoisotopic mass151.099716 Da
  • ChemSpider ID43336205

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

123983-06-2 [RN]
2-[(1S)-1-Aminopropyl]phenol [German] [ACD/IUPAC Name]
2-[(1S)-1-Aminopropyl]phenol [ACD/IUPAC Name]
2-[(1S)-1-Aminopropyl]phénol [French] [ACD/IUPAC Name]
Phenol, 2-[(1S)-1-aminopropyl]- [ACD/Index Name]
2-((1S)-1-AMINOPROPYL)PHENOL
MFCD06762052

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 262.5±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.0±3.0 kJ/mol
    Flash Point: 112.5±20.4 °C
    Index of Refraction: 1.561
    Molar Refractivity: 45.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.23
    ACD/LogD (pH 5.5): -2.02
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.11
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 46 Å2
    Polarizability: 18.2±0.5 10-24cm3
    Surface Tension: 44.8±3.0 dyne/cm
    Molar Volume: 141.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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