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Search term: MF = 'C_{12}H_{25}NO_{3}'
ChemSpider 2D Image | Methyl 3-[(3-butoxypropyl)amino]butanoate | C12H25NO3

Methyl 3-[(3-butoxypropyl)amino]butanoate

  • Molecular FormulaC12H25NO3
  • Average mass231.332 Da
  • Monoisotopic mass231.183441 Da
  • ChemSpider ID24531685

More details:

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

3-[(3-Butoxypropyl)amino]butanoate de méthyle [French] [ACD/IUPAC Name]
Butanoic acid, 3-[(3-butoxypropyl)amino]-, methyl ester [ACD/Index Name]
Methyl 3-[(3-butoxypropyl)amino]butanoate [ACD/IUPAC Name]
Methyl-3-[(3-butoxypropyl)amino]butanoat [German] [ACD/IUPAC Name]
1221342-86-4 [RN]
atoms 16 bonds 15
methyl 3-((3-butoxypropyl)amino)butanoate
methyl 3-(3-butoxypropylamino)butanoate
MFCD14707495

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

    Density: 0.9±0.1 g/cm3
    Boiling Point: 302.1±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.2±3.0 kJ/mol
    Flash Point: 136.5±23.7 °C
    Index of Refraction: 1.440
    Molar Refractivity: 64.7±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 0
    ACD/LogP: 1.57
    ACD/LogD (pH 5.5): -0.86
    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): 1.09
    ACD/KOC (pH 7.4): 16.90
    Polar Surface Area: 48 Å2
    Polarizability: 25.7±0.5 10-24cm3
    Surface Tension: 30.9±3.0 dyne/cm
    Molar Volume: 245.7±3.0 cm3

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