Oxetane, 3,3-bis-(chloromethyl)

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Gas phase thermochemistry data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Δfgas-48.75 ± 0.45kcal/molCcrRingner, Sunner, et al., 1971 

Condensed phase thermochemistry data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity Value Units Method Reference Comment
Δfliquid-62.13 ± 0.44kcal/molCcrRingner, Sunner, et al., 1971ALS
Quantity Value Units Method Reference Comment
Δcliquid-692.71 ± 0.43kcal/molCcrRingner, Sunner, et al., 1971ALS
Quantity Value Units Method Reference Comment
liquid65.58cal/mol*KN/ADainton, Evans, et al., 1962DH

Constant pressure heat capacity of liquid

Cp,liquid (cal/mol*K) Temperature (K) Reference Comment
52.27300.Dainton, Evans, et al., 1962T = 20 to 310 K.; DH

Phase change data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos
DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity Value Units Method Reference Comment
Ttriple292.16KN/ADainton, Evans, et al., 1962, 2Crystal phase 1 phase; Uncertainty assigned by TRC = 0.02 K; TRC
Quantity Value Units Method Reference Comment
Δvap13.38kcal/molN/AMajer and Svoboda, 1985 
Δvap13.38 ± 0.091kcal/molCRingner, Sunner, et al., 1971ALS
Δvap13.4 ± 0.1kcal/molCRingner, Sunner, et al., 1971AC

Enthalpy of fusion

ΔfusH (kcal/mol) Temperature (K) Reference Comment
4.051292.2Domalski and Hearing, 1996AC

Enthalpy of phase transition

ΔHtrs (kcal/mol) Temperature (K) Initial Phase Final Phase Reference Comment
4.0497292.16crystaline, IliquidDainton, Evans, et al., 1962Premelting occurs above 250 K.; DH

Entropy of phase transition

ΔStrs (cal/mol*K) Temperature (K) Initial Phase Final Phase Reference Comment
13.86292.16crystaline, IliquidDainton, Evans, et al., 1962Premelting; DH

In addition to the Thermodynamics Research Center (TRC) data available from this site, much more physical and chemical property data is available from the following TRC products:


References

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Ringner, Sunner, et al., 1971
Ringner, B.; Sunner, S.; Watanabe, H., The enthalpies of combustion and formation of some 3,3-disubstituted oxetanes, Acta Chem. Scand., 1971, 25, 141-146. [all data]

Dainton, Evans, et al., 1962
Dainton, F.S.; Evans, D.M.; Hoare, F.E.; Melia, T.P., Thermodynamic functions of linear high polymers. Part II. Thermodynamic functions of penton, Polymer, 1962, 3, 271-276. [all data]

Dainton, Evans, et al., 1962, 2
Dainton, F.S.; Evans, D.M.; Hoare, F.E.; Melia, T.P., Thermodynamic functions of linear high polymers. Part II. Penton, Polymer, 1962, 3, 271-6. [all data]

Majer and Svoboda, 1985
Majer, V.; Svoboda, V., Enthalpies of Vaporization of Organic Compounds: A Critical Review and Data Compilation, Blackwell Scientific Publications, Oxford, 1985, 300. [all data]

Domalski and Hearing, 1996
Domalski, Eugene S.; Hearing, Elizabeth D., Heat Capacities and Entropies of Organic Compounds in the Condensed Phase. Volume III, J. Phys. Chem. Ref. Data, 1996, 25, 1, 1, https://doi.org/10.1063/1.555985 . [all data]


Notes

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