ChemSpider 2D Image | 2-({3-Chloro-5-methoxy-4-[(4-methylbenzyl)oxy]benzyl}amino)-1-butanol | C20H26ClNO3

2-({3-Chloro-5-methoxy-4-[(4-methylbenzyl)oxy]benzyl}amino)-1-butanol

  • Molecular FormulaC20H26ClNO3
  • Average mass363.878 Da
  • Monoisotopic mass363.160126 Da
  • ChemSpider ID21584978

More details:

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

1-Butanol, 2-[[[3-chloro-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]amino]- [ACD/Index Name]
2-({3-Chlor-5-methoxy-4-[(4-methylbenzyl)oxy]benzyl}amino)-1-butanol [German] [ACD/IUPAC Name]
2-({3-Chloro-5-methoxy-4-[(4-methylbenzyl)oxy]benzyl}amino)-1-butanol [ACD/IUPAC Name]
2-({3-Chloro-5-méthoxy-4-[(4-méthylbenzyl)oxy]benzyl}amino)-1-butanol [French] [ACD/IUPAC Name]
1017522-17-6 [RN]
2-({3-chloro-5-methoxy-4-[(4-methylbenzyl)oxy]benzyl}amino)butan-1-ol
2-[({3-CHLORO-5-METHOXY-4-[(4-METHYLPHENYL)METHOXY]PHENYL}METHYL)AMINO]BUTAN-1-OL
2-[[3-chloro-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methylamino]butan-1-ol
2-[3-Chloro-5-methoxy-4-(4-methyl-benzyloxy)-benzylamino]-butan-1-ol
AGN-PC-01AJ3T
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 510.2±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 82.2±3.0 kJ/mol
    Flash Point: 262.3±28.7 °C
    Index of Refraction: 1.562
    Molar Refractivity: 102.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 4.63
    ACD/LogD (pH 5.5): 2.41
    ACD/BCF (pH 5.5): 10.35
    ACD/KOC (pH 5.5): 37.50
    ACD/LogD (pH 7.4): 4.12
    ACD/BCF (pH 7.4): 527.67
    ACD/KOC (pH 7.4): 1911.13
    Polar Surface Area: 51 Å2
    Polarizability: 40.6±0.5 10-24cm3
    Surface Tension: 42.3±3.0 dyne/cm
    Molar Volume: 315.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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