1,3-Dioxolane

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Phase change 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:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
DRB - Donald R. Burgess, Jr.
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos
CAL - James S. Chickos, William E. Acree, Jr., Joel F. Liebman, Students of Chem 202 (Introduction to the Literature of Chemistry), University of Missouri -- St. Louis
DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity Value Units Method Reference Comment
Tboil347.7KN/AAldrich Chemical Company Inc., 1990BS
Quantity Value Units Method Reference Comment
Tfus175.9KN/AAnonymous, 1955Uncertainty assigned by TRC = 0.6 K; TRC
Quantity Value Units Method Reference Comment
Ttriple175.93KN/AClegg and Melia, 1969Crystal phase 1 phase; Uncertainty assigned by TRC = 0.02 K; TRC
Quantity Value Units Method Reference Comment
Δvap8.48kcal/molN/APihlaja and Heikklia, 1969DRB
Δvap8.5 ± 0.1kcal/molVFletcher, Mortimer, et al., 1959ALS

Enthalpy of vaporization

ΔvapH (kcal/mol) Temperature (K) Method Reference Comment
8.27326.AWu and Sandler, 1989Based on data from 305. to 347. K.; AC
8.56295.AStephenson and Malanowski, 1987Based on data from 280. to 323. K.; AC
8.05339.N/ACastellari, Francesconi, et al., 1982Based on data from 321. to 357. K.; AC
8.05326.N/AFrancesconi, Castellari, et al., 1980Based on data from 306. to 346. K.; AC
8.15296.N/ACherkasskaya, Tur, et al., 1968Based on data from 280. to 355. K. See also Boublik, Fried, et al., 1984.; AC

Antoine Equation Parameters

log10(P) = A − (B / (T + C))
    P = vapor pressure (atm)
    T = temperature (K)

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Temperature (K) A B C Reference Comment
280.9 to 355.34.112881237.377-48.735Cherkaskaya, Petrenkova, et al., 1968Coefficents calculated by NIST from author's data.

Enthalpy of fusion

ΔfusH (kcal/mol) Temperature (K) Reference Comment
1.57175.9Domalski and Hearing, 1996AC

Entropy of fusion

ΔfusS (cal/mol*K) Temperature (K) Reference Comment
4.49142.4Domalski and Hearing, 1996CAL
8.922175.9

Enthalpy of phase transition

ΔHtrs (kcal/mol) Temperature (K) Initial Phase Final Phase Reference Comment
0.6398142.4crystaline, IIcrystaline, IClegg and Melia, 1969DH
1.570175.93crystaline, IliquidClegg and Melia, 1969DH

Entropy of phase transition

ΔStrs (cal/mol*K) Temperature (K) Initial Phase Final Phase Reference Comment
4.49142.4crystaline, IIcrystaline, IClegg and Melia, 1969DH
8.91175.93crystaline, IliquidClegg and Melia, 1969DH

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:


Gas phase ion energetics 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:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

View reactions leading to C3H6O2+ (ion structure unspecified)

Ionization energy determinations

IE (eV) Method Reference Comment
9.9PESweigart and Turner, 1972LLK
10.02EICollin and Conde, 1966RDSH
10.1PESweigart and Turner, 1972Vertical value; LLK

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
C2H2O+13.20?EICollin and Conde, 1966RDSH
C2H3O+14.14?EICollin and Conde, 1966RDSH
C2H4O+10.87CH2OEIHolmes, Terlouw, et al., 1976LLK
C2H4O+11.56?EICollin and Conde, 1966RDSH
C2H5O+12.45?EICollin and Conde, 1966RDSH
C3H5O2+10.38HEICollin and Conde, 1966RDSH

References

Go To: Top, Phase change data, Gas phase ion energetics data, Notes

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

Aldrich Chemical Company Inc., 1990
Aldrich Chemical Company Inc., Catalog Handbook of Fine Chemicals, Aldrich Chemical Company, Inc., Milwaukee WI, 1990, 1. [all data]

Anonymous, 1955
Anonymous, R., , Am. Pet. Inst. Res. Proj. 45, Tech. Rep. 14, No. 1, Ohio State Univ., 1955. [all data]

Clegg and Melia, 1969
Clegg, G.A.; Melia, T.P., Thermodynamics of polymerization of heterocyclic compounds. Part V. The heat capacity, entropy, enthalpy and free energy of 1,3-dioxolan and poly-1,3-dioxolan, Polymer, 1969, 10(12), 912-922. [all data]

Pihlaja and Heikklia, 1969
Pihlaja, K.; Heikklia, J., Enthalpies of formation of cyclic acetals. 1,3-dioxolane, 2-methyl-1,3-dioxolane, and 2,4-dimethyl-1,3-dioxolanes, Acta Chem. Scand., 1969, 23, 1053-1055. [all data]

Fletcher, Mortimer, et al., 1959
Fletcher, S.E.; Mortimer, C.T.; Springall, H.D., Heats of combustion and molecular structure. Part VII. 1:3-dioxa- and 1:3:5-trioxa-cycloalkanes, J. Chem. Soc., 1959, 580-584. [all data]

Wu and Sandler, 1989
Wu, Huey S.; Sandler, Stanley I., Vapor-liquid equilibrium of 1,3-dioxolane systems, J. Chem. Eng. Data, 1989, 34, 2, 209-213, https://doi.org/10.1021/je00056a019 . [all data]

Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw, Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2 . [all data]

Castellari, Francesconi, et al., 1982
Castellari, Carlo; Francesconi, Romolo; Comelli, Fabio, Vapor-liquid equilibriums in binary systems containing 1,3-dioxolane at isobaric conditions. 3. Binary mixtures of 1,3-dioxolane with o-, m-, and p-xylenes, J. Chem. Eng. Data, 1982, 27, 2, 156-158, https://doi.org/10.1021/je00028a017 . [all data]

Francesconi, Castellari, et al., 1980
Francesconi, Romolo; Castellari, Carlo; Arcelli, Antonio; Comelli, Fabio, Vapor-liquid equilibrium in mixtures of 1,3 dioxolane-water, Can. J. Chem. Eng., 1980, 58, 1, 113-121, https://doi.org/10.1002/cjce.5450580116 . [all data]

Cherkasskaya, Tur, et al., 1968
Cherkasskaya, E.L.; Tur, A.M.; Petrenkova, Z.F.; Lyubomilov, V.I., Zh. Prikl. Khim., 1968, 41, 11, 2553. [all data]

Boublik, Fried, et al., 1984
Boublik, T.; Fried, V.; Hala, E., The Vapour Pressures of Pure Substances: Selected Values of the Temperature Dependence of the Vapour Pressures of Some Pure Substances in the Normal and Low Pressure Region, 2nd ed., Elsevier, New York, 1984, 972. [all data]

Cherkaskaya, Petrenkova, et al., 1968
Cherkaskaya, E.L.; Petrenkova, Z.E.; Tur, A.M.; Lubinova, V.I., Phase Equilibrium of Liquid-Steam in System of Dioxolane-Water, Zh. Prikl. Khim. (Leningrad), 1968, 41, 2553-2554. [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]

Sweigart and Turner, 1972
Sweigart, D.A.; Turner, D.W., Lone pair orbitals and their interactions studied by photoelectron spectroscopy. II. Equivalent orbitals in saturated oxygen and sulfur J. Heterocycl. Chem., J. Am. Chem. Soc., 1972, 94, 5599. [all data]

Collin and Conde, 1966
Collin, J.E.; Conde, G., L'ionisation et la dissociation des polyethers cycliques soumis a l'impact electronique, Bull. Classe Sci. Acad. Roy. Belg., 1966, 52, 978. [all data]

Holmes, Terlouw, et al., 1976
Holmes, J.L.; Terlouw, J.K.; Lossing, F.P., The thermochemistry of C2H4O+ ions, J. Phys. Chem., 1976, 80, 2860. [all data]


Notes

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