Ethane, 1,2-dichloro-1,1,2,2-tetrafluoro-
- Formula: C2Cl2F4
- Molecular weight: 170.921
- IUPAC Standard InChIKey: DDMOUSALMHHKOS-UHFFFAOYSA-N
- CAS Registry Number: 76-14-2
- 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: Ethane, 1,2-dichlorotetrafluoro-; s-Dichlorotetrafluoroethane; Arcton 114; Arcton 33; Cryofluoran; Cryofluorane; F 114; Fluorocarbon 114; Freon 114; Frigen 114; Frigiderm; FC 114; Genetron 114; Genetron 316; Ledon 114; Propellant 114; R 114; Ucon 114; 1,1,2,2-Tetrafluoro-1,2-Dichloroethane; 1,2-Dichloro-1,1,2,2-tetrafluoroethane; (CF2Cl)2; 1,2-Dichlorotetrafluoroethane; Fluorane 114; Isotron 114; Refrigerant 114; sym-Dichlorotetrafluoroethane; Halocarbon 114; Halon 242; CFC-114; Dichloro-1,1,2,2-tetrafluoroethane; Refrigerant R114; F 114 (halocarbon); FKW 114; R 114 (halocarbon)
- 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.
Gas phase thermochemistry data
Go To: Top, Phase change data, Henry's Law 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°gas | -223.9 ± 1.7 | kcal/mol | Ccr | Erastov and Kolesov, 1986 | Correction of Papina and Kolesov, 1982 |
ΔfH°gas | -221. ± 3. | kcal/mol | Cm | Kirkbride and Davidson, 1954 | Reanalyzed by Kolesov and Papina, 1983, Original value = -213. ± 3. kcal/mol; Von Wartenberg method |
Phase change data
Go To: Top, Gas phase thermochemistry data, Henry's Law 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 as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
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 |
---|---|---|---|---|---|
Tboil | 276.9 | K | N/A | PCR Inc., 1990 | BS |
Tboil | 275.44 | K | N/A | Krauss and Stephan, 1989 | Uncertainty assigned by TRC = 0.2 K; TRC |
Tboil | 277.3 | K | N/A | Weast and Grasselli, 1989 | BS |
Quantity | Value | Units | Method | Reference | Comment |
Ttriple | 179. | K | N/A | Krauss and Stephan, 1989 | Uncertainty assigned by TRC = 1.5 K; TRC |
Ttriple | 180.62 | K | N/A | Kolesov, Kosarukina, et al., 1981 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.02 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tc | 418.85 | K | N/A | Krauss and Stephan, 1989 | Uncertainty assigned by TRC = 0.3 K; TRC |
Tc | 418.85 | K | N/A | Okada, Uematsu, et al., 1986 | Uncertainty assigned by TRC = 0.04 K; Tc selected from literature to correlate density measurement; TRC |
Tc | 418.9 | K | N/A | Martin, 1960 | Uncertainty assigned by TRC = 0.33 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Pc | 33.49 | atm | N/A | Krauss and Stephan, 1989 | Uncertainty assigned by TRC = 0.00006 atm; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ρc | 3.404 | mol/l | N/A | Okada, Uematsu, et al., 1986 | Uncertainty assigned by TRC = 0.0034 mol/l; Density measured with magnetic densimeter. Tc, Dc selected from literature to correlate density measurements. R114, contained 0.05% 1,1-isomer; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 5.54 ± 0.1 | kcal/mol | E | Erastov and Kolesov, 1986 | Correction of Papina and Kolesov, 1982; ALS |
ΔvapH° | 5.60 ± 0.10 | kcal/mol | C | Perlick, 1937 | ALS |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
5.81 | 292. | A | Stephenson and Malanowski, 1987 | Based on data from 277. to 391. K.; AC |
6.00 | 262. | A | Stephenson and Malanowski, 1987 | Based on data from 210. to 277. K.; AC |
6.05 | 261. | N/A | Stull, 1947 | Based on data from 178. to 277. K.; AC |
Antoine Equation Parameters
log10(P) = A − (B / (T + C))
P = vapor pressure (atm)
T = temperature (K)
View plot Requires a JavaScript / HTML 5 canvas capable browser.
Temperature (K) | A | B | C | Reference | Comment |
---|---|---|---|---|---|
177.8 to 276.7 | 3.99003 | 942.336 | -40.518 | Stull, 1947 | Coefficents calculated by NIST from author's data. |
276.7 to 414.1 | 4.14591 | 1031.026 | -27.911 | Stull, 1947 | Coefficents calculated by NIST from author's data. |
Enthalpy of fusion
ΔfusH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
0.361 | 180.6 | Domalski and Hearing, 1996 | AC |
Enthalpy of phase transition
ΔHtrs (kcal/mol) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
0.2897 | 109.3 | crystaline, III | crystaline, II | Kolesov, Kosarukina, et al., 1981, 2 | DH |
0.6281 | 134.6 | crystaline, II | crystaline, I | Kolesov, Kosarukina, et al., 1981, 2 | DH |
0.3609 | 180.62 | crystaline, I | liquid | Kolesov, Kosarukina, et al., 1981, 2 | DH |
Entropy of phase transition
ΔStrs (cal/mol*K) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
2.651 | 109.3 | crystaline, III | crystaline, II | Kolesov, Kosarukina, et al., 1981, 2 | DH |
4.66 | 134.6 | crystaline, II | crystaline, I | Kolesov, Kosarukina, et al., 1981, 2 | DH |
2.00 | 180.62 | crystaline, I | liquid | Kolesov, Kosarukina, et al., 1981, 2 | DH |
Henry's Law data
Go To: Top, Gas phase thermochemistry data, 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: Rolf Sander
Henry's Law constant (water solution)
kH(T) = k°H exp(d(ln(kH))/d(1/T) ((1/T) - 1/(298.15 K)))
k°H = Henry's law constant for solubility in water at 298.15 K (mol/(kg*bar))
d(ln(kH))/d(1/T) = Temperature dependence constant (K)
k°H (mol/(kg*bar)) | d(ln(kH))/d(1/T) (K) | Method | Reference | Comment |
---|---|---|---|---|
0.00082 | Q | N/A | missing citation give several references for the Henry's law constants but don't assign them to specific species. | |
0.00082 | V | N/A |
Gas phase ion energetics data
Go To: Top, Gas phase thermochemistry data, Phase change data, Henry's Law 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:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
12.47 | PE | Chau and McDowell, 1976 | Vertical value; LLK |
12.85 | PE | Doucet, Sauvageau, et al., 1975 | Vertical value; LLK |
Appearance energy determinations
Ion | AE (eV) | Other Products | Method | Reference | Comment |
---|---|---|---|---|---|
CF2Cl+ | 12.33 | ? | EI | Leyland, Majer, et al., 1970 | RDSH |
References
Go To: Top, Gas phase thermochemistry data, Phase change data, Henry's Law 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.
Erastov and Kolesov, 1986
Erastov, P.A.; Kolesov, V.P.,
The energy of combustion of liquid 1,2-dichlorotetrafluoroethane,
Thermochim. Acta, 1986, 109, 175-180. [all data]
Papina and Kolesov, 1982
Papina, T.S.; Kolesov, V.P.,
Standard enthalpy of formation of 1,2-dichlorotetrafluoroethane,
Petro. Chem. USSR, 1982, 56, 675-677, In original 1108. [all data]
Kirkbride and Davidson, 1954
Kirkbride, F.W.; Davidson, F.G.,
Heats of formation of gaseous fluoro- and fluorochloro-carbons,
Nature (London), 1954, 174, 79-80. [all data]
Kolesov and Papina, 1983
Kolesov, V.P.; Papina, T.S.,
Thermochemistry of Haloethanes,
Russ. Chem. Rev., 1983, 52, 425. [all data]
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]
Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]
Kolesov, Kosarukina, et al., 1981
Kolesov, V.P.; Kosarukina, E.A.; Zhogin, D.Yu.; Poloznikova, M.E.; Pentin, Y.A.,
Heat capacities, phase transitions, and thermodynamic functions of 1,1,2,2-tetrafluoro-1,2-dichloroethane and 1,1,2-trifluoro- 1,2,2-trichloroethane,
J. Chem. Thermodyn., 1981, 13, 115. [all data]
Okada, Uematsu, et al., 1986
Okada, M.; Uematsu, M.; Watanabe, K.,
Orthobaric liquid densities of trichloro-fluoromethane, dichlorodi-fluoromethane, chlorodifluoromethane, 1,1,2-trichlorotrifluoroethane, 1,2-dichlorotetrafluoroethane, and of the azeotropic mixtur,
J. Chem. Thermodyn., 1986, 18, 527. [all data]
Martin, 1960
Martin, J.J.,
Thermodynamic Properties of Dichlorotetrafluoroethane,
J. Chem. Eng. Data, 1960, 5, 334-336. [all data]
Perlick, 1937
Perlick, A.,
Calorimetric investigations on dichloromethane, difluoromonochloroethane and tetrafluorodichloroethane,
Bull. Int. Inst. Refrig., 1937, 18, 1-9. [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]
Stull, 1947
Stull, Daniel R.,
Vapor Pressure of Pure Substances. Organic and Inorganic Compounds,
Ind. Eng. Chem., 1947, 39, 4, 517-540, https://doi.org/10.1021/ie50448a022
. [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]
Kolesov, Kosarukina, et al., 1981, 2
Kolesov, V.P.; Kosarukina, E.A.; Zhogin, D.Yu.; Poloznikova, M.E.; Pentin, Yu.A.,
Heat capacities, phase transitions, and thermodynamic functions of 1,1,2,2,-tetrafluoro-1,2-dichloroethane and 1,1,3-trifluoro-1,2,2-trichloroethane,
J. Chem. Thermodynam., 1981, 13, 115-129. [all data]
Chau and McDowell, 1976
Chau, F.T.; McDowell, C.A.,
Photoelectron spectra of 1,2-dibromo-1,1-difluoroethane, 1,2-bromochloroethane, and 1,2-dichloro-, 1,2-dibromo-, and 1,2-diiodotetrafluoroethane,
J. Phys. Chem., 1976, 80, 2923. [all data]
Doucet, Sauvageau, et al., 1975
Doucet, J.; Sauvageau, P.; Sandorfy, C.,
Photoelectron far-ultraviolet absorption spectra of chlorofluoro derivatives of ethane,
J. Chem. Phys., 1975, 62, 355. [all data]
Leyland, Majer, et al., 1970
Leyland, L.M.; Majer, J.R.; Robb, J.C.,
Heat of formation of the CF2Cl. radical,
J. Chem. Soc. Faraday Trans., 1970, 66, 898. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Phase change data, Henry's Law data, Gas phase ion energetics data, References
- Symbols used in this document:
AE Appearance energy Pc Critical pressure Tboil Boiling point Tc Critical temperature Ttriple Triple point temperature d(ln(kH))/d(1/T) Temperature dependence parameter for Henry's Law constant k°H Henry's Law constant at 298.15K ΔHtrs Enthalpy of phase transition ΔStrs Entropy of phase transition ΔfH°gas Enthalpy of formation of gas at standard conditions ΔfusH Enthalpy of fusion ΔvapH Enthalpy of vaporization ΔvapH° Enthalpy of vaporization at standard conditions ρc Critical density - 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.