ChemSpider 2D Image | N1,N1,3-Trimethyl-1,3-butanediamine | C7H18N2

N1,N1,3-Trimethyl-1,3-butanediamine

  • Molecular FormulaC7H18N2
  • Average mass130.231 Da
  • Monoisotopic mass130.147003 Da
  • ChemSpider ID23499427

More details:

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

1,3-Butanediamine, N1,N1,3-trimethyl- [ACD/Index Name]
933738-55-7 [RN]
N1,N1,3-Trimethyl-1,3-butandiamin [German] [ACD/IUPAC Name]
N1,N1,3-Trimethyl-1,3-butanediamine [ACD/IUPAC Name]
N1,N1,3-Triméthyl-1,3-butanediamine [French] [ACD/IUPAC Name]
N1,N1,3-Trimethylbutane-1,3-diamine
N1,N1,3-Trimethyl-1,3-butanediamine
(3-amino-3-methylbutyl)dimethylamine
1-N,1-N,3-trimethylbutane-1,3-diamine
AGN-PC-03U4IF
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 0.8±0.1 g/cm3
    Boiling Point: 158.1±8.0 °C at 760 mmHg
    Vapour Pressure: 2.7±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 39.5±3.0 kJ/mol
    Flash Point: 46.4±13.1 °C
    Index of Refraction: 1.450
    Molar Refractivity: 41.7±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.40
    ACD/LogD (pH 5.5): -3.48
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.17
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 29 Å2
    Polarizability: 16.5±0.5 10-24cm3
    Surface Tension: 29.2±3.0 dyne/cm
    Molar Volume: 155.1±3.0 cm3

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