ChemSpider 2D Image | N-(1,1-Dimethylethyl)-1-octanamine | C12H27N


  • Molecular FormulaC12H27N
  • Average mass185.350 Da
  • Monoisotopic mass185.214355 Da
  • ChemSpider ID24327269

More details:

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

1-Octanamine, N-(1,1-dimethylethyl)- [ACD/Index Name]
38632-95-0 [RN]
N-(2-Methyl-2-propanyl)-1-octanamin [German] [ACD/IUPAC Name]
N-(2-Methyl-2-propanyl)-1-octanamine [ACD/IUPAC Name]
N-(2-Méthyl-2-propanyl)-1-octanamine [French] [ACD/IUPAC Name]

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

  • Gas Chromatography
    • Retention Index (Kovats):

      1233 (Program type: Isothermal; Col... (show more) umn class: Semi-standard non-polar; Column length: 2.7 m; Column type: Packed; Start T: 100 C; CAS no: 38632950; Active phase: Apiezon L; Carrier gas: N2; Substrate: Chromosorb GAW; Data type: Kovats RI; Authors: Golovnya, R.V.; Zhuravleva, I.L.; Svetlova, N.I.; Grigor'eva, D.N.; Terenina, M.B.; Gutnik, S.B., Gas-chromatographic behavior of secondary isoaliphatic and alicyclic amines, J. Anal. Chem. USSR (Engl. Transl.), 36(4), 1981, 501-505, In original 742-747.) NIST Spectra nist ri

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

Density: 0.8±0.1 g/cm3
Boiling Point: 227.6±8.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.4±3.0 kJ/mol
Flash Point: 74.7±9.3 °C
Index of Refraction: 1.433
Molar Refractivity: 61.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.52
ACD/LogD (pH 5.5): 1.46
ACD/BCF (pH 5.5): 1.36
ACD/KOC (pH 5.5): 5.72
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 1.86
ACD/KOC (pH 7.4): 7.80
Polar Surface Area: 12 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 26.2±3.0 dyne/cm
Molar Volume: 235.5±3.0 cm3

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