ChemSpider 2D Image | 277L28816Q | C8H18O2

277L28816Q

  • Molecular FormulaC8H18O2
  • Average mass146.227 Da
  • Monoisotopic mass146.130676 Da
  • ChemSpider ID21159455

More details:

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

1-(1-Propoxyethoxy)propan [German] [ACD/IUPAC Name]
1-(1-Propoxyethoxy)propane [ACD/IUPAC Name]
1-(1-Propoxyéthoxy)propane [French] [ACD/IUPAC Name]
1,1'-(Ethylidenebis(oxy))bispropane
1,1-Dipropoxyethane
105-82-8 [RN]
1697928 [Beilstein]
203-335-2 [EINECS]
277L28816Q
3OY1&O3 [WLN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

BRN 1697928 [DBID]
  • Gas Chromatography

    • Retention Index (Kovats):

      904 (estimated with error: 68) NIST Spectra mainlib_4284, replib_249005, replib_4285, replib_279776
      856 (Program type: Isothermal; Col... (show more) umn class: Semi-standard non-polar; Column type: Packed; Start T: 120 C; CAS no: 105828; Active phase: Apiezon L; Substrate: Celite 545; Data type: Kovats RI; Authors: Bogoslovsky, Yu.N.; Anvaer, B.I.; Vigdergauz, M.S., Chromatographic constants in gas chromatography (in Russian), Standards Publ. House, Moscow, 1978, 192.) NIST Spectra nist ri
      863 (Program type: Isothermal; Col... (show more) umn class: Semi-standard non-polar; Column type: Packed; Start T: 160 C; CAS no: 105828; Active phase: Apiezon L; Substrate: Celite 545; Data type: Kovats RI; Authors: Bogoslovsky, Yu.N.; Anvaer, B.I.; Vigdergauz, M.S., Chromatographic constants in gas chromatography (in Russian), Standards Publ. House, Moscow, 1978, 192.) NIST Spectra nist ri

    • Retention Index (Normal Alkane):

      865.5 (Program type: Ramp; Column cl... (show more) ass: Standard non-polar; Column diameter: 0.02 in; Column length: 500 ft; Column type: Capillary; Heat rate: 1.4 K/min; Start T: 32 C; End T: 172 C; CAS no: 105828; Active phase: SF-96; Carrier gas: He; Data type: Normal alkane RI; Authors: Stevens, K.L.; Flath, R.A.; Lee, A.; Stern, D.J., Volatiles from grapes. Comparison of grenache juice and grenache Rose wine, J. Agric. Food Chem., 17(5), 1969, 1102-1106.) 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: 146.5±0.0 °C at 760 mmHg
Vapour Pressure: 5.8±0.2 mmHg at 25°C
Enthalpy of Vaporization: 36.8±3.0 kJ/mol
Flash Point: 30.4±18.0 °C
Index of Refraction: 1.405
Molar Refractivity: 42.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.36
ACD/KOC (pH 5.5): 210.53
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 12.36
ACD/KOC (pH 7.4): 210.53
Polar Surface Area: 18 Å2
Polarizability: 16.9±0.5 10-24cm3
Surface Tension: 24.7±3.0 dyne/cm
Molar Volume: 173.7±3.0 cm3

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