ChemSpider 2D Image | 1-(1,4-Diazepan-1-yl)-3-(dimethylamino)-2-propanol | C10H23N3O

1-(1,4-Diazepan-1-yl)-3-(dimethylamino)-2-propanol

  • Molecular FormulaC10H23N3O
  • Average mass201.309 Da
  • Monoisotopic mass201.184113 Da
  • ChemSpider ID29376340

More details:

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

1-(1,4-Diazepan-1-yl)-3-(dimethylamino)-2-propanol [German] [ACD/IUPAC Name]
1-(1,4-Diazepan-1-yl)-3-(dimethylamino)-2-propanol [ACD/IUPAC Name]
1-(1,4-Diazépan-1-yl)-3-(diméthylamino)-2-propanol [French] [ACD/IUPAC Name]
1H-1,4-Diazepine-1-ethanol, α-[(dimethylamino)methyl]hexahydro- [ACD/Index Name]
1-(1,4-diazepan-1-yl)-3-(dimethylamino)propan-2-ol
1-[1,4]Diazepan-1-yl-3-dimethylamino-propan-2-ol
1351393-06-0 [RN]
AGN-PC-0ACBDA
AKOS005261620
MFCD20491720

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 297.1±29.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 62.3±6.0 kJ/mol
    Flash Point: 133.5±24.3 °C
    Index of Refraction: 1.486
    Molar Refractivity: 58.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.68
    ACD/LogD (pH 5.5): -4.41
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.00
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 39 Å2
    Polarizability: 23.2±0.5 10-24cm3
    Surface Tension: 35.5±3.0 dyne/cm
    Molar Volume: 203.5±3.0 cm3

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