ChemSpider 2D Image | 2-(Benzylamino)-4-methyl-1-pentanol | C13H21NO

2-(Benzylamino)-4-methyl-1-pentanol

  • Molecular FormulaC13H21NO
  • Average mass207.312 Da
  • Monoisotopic mass207.162308 Da
  • ChemSpider ID11361221

More details:

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

1-Pentanol, 4-methyl-2-[(phenylmethyl)amino]- [ACD/Index Name]
2-(Benzylamino)-4-methyl-1-pentanol [German] [ACD/IUPAC Name]
2-(Benzylamino)-4-methyl-1-pentanol [ACD/IUPAC Name]
2-(Benzylamino)-4-méthyl-1-pentanol [French] [ACD/IUPAC Name]
10249-88-4 [RN]
1932250-31-1 [RN]
1-pentanol, 4-methyl-2-[(phenylmethyl)amino]
2-(benzylamino)-4-methylpentan-1-ol
92111-70-1 [RN]
MFCD12826138 [MDL number]

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 331.7±17.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.6±3.0 kJ/mol
    Flash Point: 98.8±11.6 °C
    Index of Refraction: 1.516
    Molar Refractivity: 64.0±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.88
    ACD/LogD (pH 5.5): -0.55
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.73
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 10.07
    Polar Surface Area: 32 Å2
    Polarizability: 25.4±0.5 10-24cm3
    Surface Tension: 36.9±3.0 dyne/cm
    Molar Volume: 211.9±3.0 cm3

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