Cycloheptane
- Formula: C7H14
- Molecular weight: 98.1861
- IUPAC Standard InChIKey: DMEGYFMYUHOHGS-UHFFFAOYSA-N
- CAS Registry Number: 291-64-5
- Chemical structure:
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Phase change data
Go To: Top, 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:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
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 |
---|---|---|---|---|---|
Tboil | 392.0 ± 0.9 | K | AVG | N/A | Average of 8 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 264. ± 3. | K | AVG | N/A | Average of 6 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
Ttriple | 265. | K | N/A | Finke, Scott, et al., 1956 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.07 K; TRC |
Ttriple | 265.12 | K | N/A | Finke, Scott, et al., 1956 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.05 K; TRC |
Ttriple | 265.1 | K | N/A | Kaarsemaker, 1951 | Uncertainty assigned by TRC = 3. K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tc | 604.2 ± 0.5 | K | N/A | Daubert, 1996 | |
Tc | 604.2 | K | N/A | Hicks and Young, 1971 | Uncertainty assigned by TRC = 0.5 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Pc | 38.2 ± 0.4 | bar | N/A | Daubert, 1996 | |
Pc | 38.13 | bar | N/A | Young, 1972 | Uncertainty assigned by TRC = 0.50 bar; TRC |
Pc | 38.26 | bar | N/A | Hicks and Young, 1971 | Uncertainty assigned by TRC = 0.4053 bar; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Vc | 0.353 | l/mol | N/A | Daubert, 1996 | |
Vc | 0.354 | l/mol | N/A | Young, 1972 | Uncertainty assigned by TRC = 0.007 l/mol; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ρc | 2.83 ± 0.04 | mol/l | N/A | Daubert, 1996 | |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 38.5 | kJ/mol | N/A | Anand, Grolier, et al., 1975 | Based on data from 283. to 323. K.; AC |
ΔvapH° | 38.5 ± 2.1 | kJ/mol | V | Finke, Scott, et al., 1956, 2 | ALS |
ΔvapH° | 38.5 ± 0.2 | kJ/mol | N/A | Finke, Scott, et al., 1956, 3 | AC |
ΔvapH° | 39.4 | kJ/mol | V | Kaarsemaker and Coops, 1952 | ALS |
ΔvapH° | 37. | kJ/mol | E | Spitzer and Huffman, 1947 | ALS |
Enthalpy of vaporization
ΔvapH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
38.6 | 297. | A | Stephenson and Malanowski, 1987 | Based on data from 282. to 333. K.; AC |
31.7 | 491. | A | Stephenson and Malanowski, 1987 | Based on data from 476. to 604. K.; AC |
36.4 | 348. | A,EB | Stephenson and Malanowski, 1987 | Based on data from 333. to 398. K. See also Meyer and Hotz, 1976.; AC |
36.1 | 356. | A,EB | Stephenson and Malanowski, 1987 | Based on data from 341. to 433. K. See also Finke, Scott, et al., 1956, 3.; AC |
Antoine Equation Parameters
log10(P) = A − (B / (T + C))
P = vapor pressure (bar)
T = temperature (K)
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Temperature (K) | A | B | C | Reference | Comment |
---|---|---|---|---|---|
341.3 to 432.17 | 3.9771 | 1330.402 | -56.946 | Finke, Scott, et al., 1956, 3 | Coefficents calculated by NIST from author's data. |
Enthalpy of sublimation
ΔsubH (kJ/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
53.5 | 134. | Bondi, 1963 | AC |
Enthalpy of fusion
ΔfusH (kJ/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
1.88 | 265.1 | Domalski and Hearing, 1996 | AC |
Entropy of fusion
ΔfusS (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
36.94 | 134.8 | Domalski and Hearing, 1996 | CAL |
1.46 | 198.2 | ||
2.11 | 212.4 | ||
7.1 | 265.1 |
Temperature of phase transition
Ttrs (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|
135.7 | crystaline, IV | crystaline, III | Haines and Gilson, 1990 | DH |
206.3 | crystaline, III | crystaline, I | Haines and Gilson, 1990 | Overlap of the III to II and the II to I transitions.; DH |
Enthalpy of phase transition
ΔHtrs (kJ/mol) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
4.9664 | 134.8 | crystaline, IV | crystaline, III | Finke, Scott, et al., 1956, 3 | DH |
0.2895 | 198.2 | crystaline, III | crystaline, II | Finke, Scott, et al., 1956, 3 | DH |
0.4498 | 212.4 | crystaline, II | crystaline, I | Finke, Scott, et al., 1956, 3 | DH |
1.8820 | 265.12 | crystaline, I | liquid | Finke, Scott, et al., 1956, 3 | DH |
Entropy of phase transition
ΔStrs (J/mol*K) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
36.84 | 134.8 | crystaline, IV | crystaline, III | Finke, Scott, et al., 1956, 3 | DH |
1.46 | 198.2 | crystaline, III | crystaline, II | Finke, Scott, et al., 1956, 3 | DH |
2.12 | 212.4 | crystaline, II | crystaline, I | Finke, Scott, et al., 1956, 3 | DH |
7.10 | 265.12 | crystaline, I | liquid | Finke, Scott, et al., 1956, 3 | DH |
References
Go To: Top, Phase change data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Finke, Scott, et al., 1956
Finke, H.L.; Scott, D.W.; Gross, M.E.; Messerly, J.F.; Waddington, G.,
Cycloheptane, Cyclooctane and 1,3,5-Cycloheptatriene. Low Temperature Thermal Properties, Vapor Pressure and Derived Chemical Thermodynamic Prop.,
J. Am. Chem. Soc., 1956, 78, 5469. [all data]
Kaarsemaker, 1951
Kaarsemaker, S.,
, Thesis, 1951. [all data]
Daubert, 1996
Daubert, T.E.,
Vapor-Liquid Critical Properties of Elements and Compounds. 5. Branched Alkanes and Cycloalkanes,
J. Chem. Eng. Data, 1996, 41, 365-372. [all data]
Hicks and Young, 1971
Hicks, C.P.; Young, C.L.,
Critical Temperatures of Mixtures of Quasi-spherical Molecules. Alicyclic Hydrocarbons + Benzene, + Hexafluorobenzene and + Perfluorocyclohexane,
Trans. Faraday Soc., 1971, 67, 1605-11. [all data]
Young, 1972
Young, C.L.,
Gas-liquid critical properties of the cycloalkanes and their mixtures,
Aust. J. Chem., 1972, 25, 1625-30. [all data]
Anand, Grolier, et al., 1975
Anand, Subhash C.; Grolier, Jean P.E.; Kiyohara, Osamu; Halpin, Carl J.; Benson, George C.,
Thermodynamic properties of some cycloalkane-cycloalkanol systems at 298. 15K. III,
J. Chem. Eng. Data, 1975, 20, 2, 184-189, https://doi.org/10.1021/je60065a020
. [all data]
Finke, Scott, et al., 1956, 2
Finke, H.L.; Scott, D.W.; Gross, M.E.; Messerly, J.F.; Waddington, G.,
Cycloheptane, cyclooctane and 1,3,5-cycloheptatriene. Low temperature thermal properties, vapor pressure and derived chemical thermodynamic properties,
J. Am. Chem. Soc., 1956, 78, 5469-54. [all data]
Finke, Scott, et al., 1956, 3
Finke, H.L.; Scott, D.W.; Gross, M.E.; Messerly, J.F.; Waddington, G.,
Cycloheptane, cyclooctane and 1,3,5-cycloheptatriene. Low temperature thermal properties, vapor pressure and derived chemical thermodynamic properties,
J. Am. Chem. Soc., 1956, 78, 5469-5476. [all data]
Kaarsemaker and Coops, 1952
Kaarsemaker, S.; Coops, J.,
Thermal quantities of some cycloparaffins. Part III. Results of measurements,
Rec. Trav. Chim. Pays/Bas, 1952, 71, 261. [all data]
Spitzer and Huffman, 1947
Spitzer, R.; Huffman, H.M.,
The heats of combustion of cyclopentane, cyclohexane, cycloheptane and cyclooctane,
J. Am. Chem. Soc., 1947, 69, 211-213. [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]
Meyer and Hotz, 1976
Meyer, Edwin F.; Hotz, Carol A.,
Cohesive energies in polar organic liquids. 3. Cyclic ketones,
J. Chem. Eng. Data, 1976, 21, 3, 274-279, https://doi.org/10.1021/je60070a035
. [all data]
Bondi, 1963
Bondi, A.,
Heat of Siblimation of Molecular Crystals: A Catalog of Molecular Structure Increments.,
J. Chem. Eng. Data, 1963, 8, 3, 371-381, https://doi.org/10.1021/je60018a027
. [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]
Haines and Gilson, 1990
Haines, J.; Gilson, D.F.R.,
Investigation of the phase transition behavior in solid cycloheptane,
J. Phys. Chem., 1990, 94, 3156-3160. [all data]
Notes
Go To: Top, Phase change data, References
- Symbols used in this document:
Pc Critical pressure Tboil Boiling point Tc Critical temperature Tfus Fusion (melting) point Ttriple Triple point temperature Ttrs Temperature of phase transition Vc Critical volume ΔHtrs Enthalpy of phase transition ΔStrs Entropy of phase transition ΔfusH Enthalpy of fusion ΔfusS Entropy of fusion ΔsubH Enthalpy of sublimation ΔvapH Enthalpy of vaporization ΔvapH° Enthalpy of vaporization at standard conditions ρc Critical density - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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