Cyclobutane, octafluoro-
- Formula: C4F8
- Molecular weight: 200.0300
- IUPAC Standard InChIKey: BCCOBQSFUDVTJQ-UHFFFAOYSA-N
- CAS Registry Number: 115-25-3
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: Cyclooctafluorobutane; Freon C 318; Freon 318; FC-C 318; Octafluorocyclobutane; Perfluorocyclobutane; Propellant C 318; R C318; Halocarbon C-138; UN 1976; Cyclobutane, 1,1,2,2,3,3,4,4-octafluoro-
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Data at other public NIST sites:
- Options:
Data at NIST subscription sites:
NIST subscription sites provide data under the NIST Standard Reference Data Program, but require an annual fee to access. The purpose of the fee is to recover costs associated with the development of data collections included in such sites. Your institution may already be a subscriber. Follow the links above to find out more about the data in these sites and their terms of usage.
Phase change data
Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), 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
DH - Eugene S. Domalski and Elizabeth D. Hearing
AC - William E. Acree, Jr., James S. Chickos
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 267.3 | K | N/A | PCR Inc., 1990 | BS |
Tboil | 266.88 | K | N/A | Krauss and Stephan, 1989 | Uncertainty assigned by TRC = 0.2 K; TRC |
Tboil | 223. | K | N/A | Park, Benning, et al., 1947 | Uncertainty assigned by TRC = 10. K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 233. | K | N/A | Park, Benning, et al., 1947 | Uncertainty assigned by TRC = 5. K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Ttriple | 232.96 | K | N/A | Krauss and Stephan, 1989 | Uncertainty assigned by TRC = 0.2 K; TRC |
Ttriple | 232.96 | K | N/A | Furukawa, McCoskey, et al., 1954 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.02 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tc | 388.46 | K | N/A | Krauss and Stephan, 1989 | Uncertainty assigned by TRC = 0.3 K; TRC |
Tc | 388.44 | K | N/A | Mousa, Kay, et al., 1972 | Uncertainty assigned by TRC = 0.2 K; TRC |
Tc | 388.37 | K | N/A | Douslin, Moore, et al., 1959 | Uncertainty assigned by TRC = 0.1 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Pc | 27.84 | bar | N/A | Krauss and Stephan, 1989 | Uncertainty assigned by TRC = 0.05 bar; TRC |
Pc | 27.85 | bar | N/A | Mousa, Kay, et al., 1972 | Uncertainty assigned by TRC = 0.0344 bar; TRC |
Pc | 27.775 | bar | N/A | Douslin, Moore, et al., 1959 | Uncertainty assigned by TRC = 0.081 bar; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Vc | 0.325 | l/mol | N/A | Douslin, Moore, et al., 1959 | Uncertainty assigned by TRC = 0.02 l/mol; TRC |
Enthalpy of vaporization
ΔvapH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
23.721 | 261.25 | N/A | Furukawa, McCoskey, et al., 1954, 2 | P = 78.78; DH |
23.5 | 304. | A | Stephenson and Malanowski, 1987 | Based on data from 289. to 348. K.; AC |
23.2 | 358. | A | Stephenson and Malanowski, 1987 | Based on data from 343. to 388. K.; AC |
24.9 | 259. | A | Stephenson and Malanowski, 1987 | Based on data from 233. to 274. K. See also Furukawa, McCoskey, et al., 1954.; AC |
25. | 248. | N/A | Kletskii and Petrik, 1967 | Based on data from 233. to 388. K.; AC |
25. | 254. | N/A | Martin, 1962 | Based on data from 234. to 269. K. See also Boublik, Fried, et al., 1984.; AC |
Entropy of vaporization
ΔvapS (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
90.80 | 261.25 | Furukawa, McCoskey, et al., 1954, 2 | P; DH |
Antoine Equation Parameters
log10(P) = A − (B / (T + C))
P = vapor pressure (bar)
T = temperature (K)
View plot Requires a JavaScript / HTML 5 canvas capable browser.
Temperature (K) | A | B | C | Reference | Comment |
---|---|---|---|---|---|
233. to 388.37 | 4.254 | 1007.399 | -30.205 | Kletskii and Petric, 1967 | Coefficents calculated by NIST from author's data. |
Enthalpy of phase transition
ΔHtrs (kJ/mol) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
2.7682 | 232.96 | crystaline, I | liquid | Furukawa, McCoskey, et al., 1954, 2 | DH |
Entropy of phase transition
ΔStrs (J/mol*K) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
11.89 | 232.96 | crystaline, I | liquid | Furukawa, McCoskey, et al., 1954, 2 | DH |
Gas phase ion energetics data
Go To: Top, Phase change data, Mass spectrum (electron ionization), 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:
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
B - John E. Bartmess
View reactions leading to C4F8+ (ion structure unspecified)
Electron affinity determinations
EA (eV) | Method | Reference | Comment |
---|---|---|---|
0.630 ± 0.050 | Kine | Miller, Freidman, et al., 2004 | Re-determination of foreward/reverse rates constants, to refute Hiraoka, Mizuno, et al., 2002 higher value.See also Bopp, Roscioli, et al., 2007; B |
0.630 ± 0.020 | Kine | Miller, Morris, et al., 1994 | FALP experiment: ratio of attach/detach rate constants; B |
0.520 ± 0.052 | IMRE | Hiraoka, Mizuno, et al., 2002 | isomer, accessible at >350 K; B |
1.05 ± 0.10 | IMRE | Hiraoka, Mizuno, et al., 2002 | equilibrium vs. SF6; may be kinetic stationary state; B |
>0.40 ± 0.30 | Endo | Lifshitz, Tiernan, et al., 1973 | B |
Appearance energy determinations
Ion | AE (eV) | Other Products | Method | Reference | Comment |
---|---|---|---|---|---|
CF3+ | 15.7 | ? | EI | Bibby and Carter, 1963 | RDSH |
C2F4+ | 12.25 | ? | EI | Bibby and Carter, 1963 | RDSH |
C3F5+ | 12.25 | ? | EI | Bibby and Carter, 1963 | RDSH |
F+ | 24.0 | ? | EI | Bibby and Carter, 1963 | RDSH |
Mass spectrum (electron ionization)
Go To: Top, Phase change data, Gas phase ion energetics 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 by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
Notice: This spectrum may be better viewed with a Javascript and HTML 5 enabled browser.
Additional Data
View image of digitized spectrum (can be printed in landscape orientation).
Due to licensing restrictions, this spectrum cannot be downloaded.
Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
NIST MS number | 9037 |
References
Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
PCR Inc., 1990
PCR Inc.,
Research Chemicals Catalog 1990-1991, PCR Inc., Gainesville, FL, 1990, 1. [all data]
Krauss and Stephan, 1989
Krauss, R.; Stephan, K.,
Thermal Conductivity of Refrigerants in a Wide Range of Temperature and Pressure,
J. Phys. Chem. Ref. Data, 1989, 18, 43. [all data]
Park, Benning, et al., 1947
Park, J.D.; Benning, A.F.; Downing, F.B.; Laucius, J.F.; McHarness, R.C.,
Synthesis of Tetrafluoroethylene. Pyrolysis of Monochlorodifluoromethane,
Ind. Eng. Chem., 1947, 39, 343-8. [all data]
Furukawa, McCoskey, et al., 1954
Furukawa, G.T.; McCoskey, R.E.; Reilly, M.L.,
Heat capacity, heats of transitions, fusion, and vaporization, and vapor pressure of octafluorocyclobutane,
J. RES. NATL. BUR. STAN., 1954, 52, 1, 11, https://doi.org/10.6028/jres.052.003
. [all data]
Mousa, Kay, et al., 1972
Mousa, A.H.N.; Kay, W.B.; Kreglewski, A.,
The critical constants of binary mixtures of certain perfluoro-compounds with alkanes,
J. Chem. Thermodyn., 1972, 4, 301-11. [all data]
Douslin, Moore, et al., 1959
Douslin, D.R.; Moore, R.T.; Waddington, G.,
The pressure-volume-temperature properties of perfluorocyclobutane: equations of state, viral coefficients and intermolecular potential energy functions,
J. Phys. Chem., 1959, 63, 1959. [all data]
Furukawa, McCoskey, et al., 1954, 2
Furukawa, G.T.; McCoskey, R.E.; Reilly, M.L.,
Heat capacity, heats of transitions, fusion and vaporization, and vapor pressure of octafluorocyclobutane,
J. Res., 1954, NBS 52, 11-16. [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]
Kletskii and Petrik, 1967
Kletskii, A.V.; Petrik, L.E.,
Zh. Fiz. Khim., 1967, 41, 5, 1183. [all data]
Martin, 1962
Martin, J.J.,
Thermodynamic Properties of Perfluorocyclobutane.,
J. Chem. Eng. Data, 1962, 7, 1, 68-72, https://doi.org/10.1021/je60012a020
. [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]
Kletskii and Petric, 1967
Kletskii, A.B.; Petric, L.E.,
Dependence of Vapor Pressure of Perfluorocyclobutane,
Zh. Fiz. Khim., 1967, 41, 1183-1184. [all data]
Miller, Freidman, et al., 2004
Miller, T.M.; Freidman, J.F.; Viggiano, A.A.,
Electron Attachment and detachment and the Electron Affinity of cyclo-C4F8,
J. Chem. Phys., 2004, 120, 15, 7024-7028, https://doi.org/10.1063/1.1683082
. [all data]
Hiraoka, Mizuno, et al., 2002
Hiraoka, K.; Mizuno, T.; Eguchi, D.; Takao, K.; Iino, T.; Yamabe, S.,
Gas-phase ion/molecule reactions in octafluorocyclobutane,
J. Chem. Phys., 2002, 116, 17, 7574-7582, https://doi.org/10.1063/1.1400787
. [all data]
Bopp, Roscioli, et al., 2007
Bopp, J.C.; Roscioli, J.R.; Johnson, M.A.; Miller, T.M.; Viggiano, A.A.; Villano, S.M.; Wren, S.W.; Lineberger,
Spectroscopic characterization of the isolated SF6- and C4F8- anions: Observation of very long harmonic progressions in symmetric deformation modes upon photodetachment,
J. Phys. Chem. A, 2007, 111, 7, 1214-1221, https://doi.org/10.1021/jp0665372
. [all data]
Miller, Morris, et al., 1994
Miller, T.M.; Morris, R.A.; Miller, A.E.S.; Viggiano, A.A.; Paulson, J.F.,
Observation of Thermal Electron Detachment from Cyclo-C4F8- in FALP Experiments,
Int. J. Mass Spectrom. Ion Proc., 1994, 135, 2-3, 195, https://doi.org/10.1016/0168-1176(94)03999-2
. [all data]
Lifshitz, Tiernan, et al., 1973
Lifshitz, C.; Tiernan, T.O.; Hughes, B.M.,
Electron affinities from endothermic negative-ion charge transfer reactions. IV. SF6, selected fluorocarbons, and other polyatomic molecules,
J. Chem. Phys., 1973, 59, 3182. [all data]
Bibby and Carter, 1963
Bibby, M.M.; Carter, G.,
Ionization and dissociation in some fluorocarbon gases,
J. Chem. Soc. Faraday Trans., 1963, 59, 2455. [all data]
Notes
Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), References
- Symbols used in this document:
AE Appearance energy EA Electron affinity Pc Critical pressure Tboil Boiling point Tc Critical temperature Tfus Fusion (melting) point Ttriple Triple point temperature Vc Critical volume ΔHtrs Enthalpy of phase transition ΔStrs Entropy of phase transition ΔvapH Enthalpy of vaporization ΔvapS Entropy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
- The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
- Customer support for NIST Standard Reference Data products.