Ethene, 1,1-dichloro-2,2-difluoro-
- Formula: C2Cl2F2
- Molecular weight: 132.924
- IUPAC Standard InChIKey: QDGONURINHVBEW-UHFFFAOYSA-N
- CAS Registry Number: 79-35-6
- Chemical structure:
This structure is also available as a 2d Mol file - Species with the same structure:
- Other names: Ethylene, 1,1-dichloro-2,2-difluoro-; Genetron 1112a; 1,1-Dichloro-2,2-difluoroethene; 1,1-Dichloro-2,2-difluoroethylene; 1,1-Dichlorodifluoroethylene; 1,1-Difluoro-2,2-dichloroethylene; CF2=CCl2; Genetrone 1112a; CFC 1112a; F 1112a; R 1112a; Ethylene, 1,2-dichloro-1,2-difluoro-
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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 by: Robert L. Brown and Stephen E. Stein
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 292. | K | N/A | PCR Inc., 1990 |
Reaction 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
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.
Individual Reactions
By formula: CH4O + C2Cl2F2 = C3H4Cl2F2O
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -38.0 ± 0.5 | kcal/mol | Cm | Kennedy, Lacher, et al., 1969 | gas phase |
ΔrH° | -37.2 | kcal/mol | Cm | Hine and Rogers, 1968 | gas phase |
By formula: Cl2 + C2Cl2F2 = C2Cl4F2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -41.08 ± 0.56 | kcal/mol | Cm | Lacher, McKinley, et al., 1949 | gas phase; Heat of chlorination at 363 °K |
By formula: 3H2 + C2Cl2F2 = C2H4F2 + 2HCl
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -83.33 | kcal/mol | Chyd | Lacher, Kianpour, et al., 1956 | gas phase; At 410 K |
By formula: H2 + C2Cl2F2 = C2HClF2 + HCl
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -21.56 | kcal/mol | Chyd | Lacher, Kianpour, et al., 1956 | gas phase; At 298 K |
+ = C5H8Cl2F2O
By formula: C3H8O + C2Cl2F2 = C5H8Cl2F2O
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -43.7 ± 0.3 | kcal/mol | Eqk | Kennedy, Lacher, et al., 1969 | gas phase |
+ = C4H6Cl2F2O
By formula: C2H6O + C2Cl2F2 = C4H6Cl2F2O
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -39.3 ± 0.6 | kcal/mol | Cm | Kennedy, Lacher, et al., 1969 | gas phase |
+ = C5H8Cl2F2O
By formula: C3H8O + C2Cl2F2 = C5H8Cl2F2O
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -39.1 ± 0.4 | kcal/mol | Cm | Kennedy, Lacher, et al., 1969 | gas phase |
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 evaluated as indicated in comments:
L - Sharon G. Lias
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
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
IE (evaluated) | 9.65 ± 0.03 | eV | N/A | N/A | L |
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
9.62 | PE | Cullen, Frost, et al., 1972 | LLK |
9.69 ± 0.01 | S | Scott and Russell, 1971 | LLK |
9.65 | PE | Lake and Thompson, 1970 | RDSH |
9.82 ± 0.02 | EI | Bunzli, Frost, et al., 1976 | Vertical value; LLK |
Mass spectrum (electron ionization)
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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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
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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 | 20889 |
UV/Visible spectrum
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Spectrum
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Additional Data
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Source | Lacher and Park, 1950 |
---|---|
Owner | INEP CP RAS, NIST OSRD Collection (C) 2007 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
Origin | INSTITUTE OF ENERGY PROBLEMS OF CHEMICAL PHYSICS, RAS |
Source reference | RAS UV No. 10172 |
Instrument | Beckman DU |
Melting point | - 116 |
Boiling point | 19 |
Gas Chromatography
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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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Normal alkane RI, non-polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | Porapack Q | 428. | Zenkevich and Rodin, 2004 | Program: not specified |
Capillary | Methyl Silicone | 454. | Zenkevich, 1999 | Program: not specified |
Capillary | Polydimethyl siloxanes | 454. | Zenkevich, 1997 | Program: not specified |
References
Go To: Top, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, Mass spectrum (electron ionization), UV/Visible spectrum, Gas Chromatography, 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]
Kennedy, Lacher, et al., 1969
Kennedy, M.B.; Lacher, J.R.; Park, J.D.,
Reaction heats of organic compounds. VI. Heats of addition of some alcohols to 1,1-dichloro-2,2-difluoroethylene,
Trans. Faraday Soc., 1969, 65, 1435-1442. [all data]
Hine and Rogers, 1968
Hine, J.; Rogers, F.E.,
Stabilizing interactions between substituents attached to the same saturated carbon atom. Enthalpies of addition of methanol, pyrrolidine, and 1-butanethiol to 1,1-dichloro-2,2-difluoroethylene,
J. Am. Chem. Soc., 1968, 90, 6701-6. [all data]
Lacher, McKinley, et al., 1949
Lacher, J.R.; McKinley, J.J.; Walden, C.; Lea, K.; Park, J.D.,
Reaction heats of organic fluorine compounds. II. The vapor phase heats of chlorination of some simple fluoroolefins,
J. Am. Chem. Soc., 1949, 71, 1334-1337. [all data]
Lacher, Kianpour, et al., 1956
Lacher, J.R.; Kianpour, A.; Oetting, F.; Park, J.D.,
Reaction calorimetry. The hydrogenation of organic fluorides and chlorides,
Trans. Faraday Soc., 1956, 52, 1500-1508. [all data]
Cullen, Frost, et al., 1972
Cullen, W.R.; Frost, D.C.; Leeder, W.R.,
The ultraviolet and photoelectron spectra of some unsaturated fluorocarbon derivatives,
J. Fluorine Chem., 1972, 1, 227. [all data]
Scott and Russell, 1971
Scott, J.D.; Russell, B.R.,
The vacuum ultraviolet absorption spectrum of 1,1-dichloro-2,2-difluoroethylene,
Chem. Phys. Lett., 1971, 9, 375. [all data]
Lake and Thompson, 1970
Lake, R.F.; Thompson, H.,
Photoelectron spectra of halogenated ethylenes,
Proc. Roy. Soc. (London), 1970, A315, 323. [all data]
Bunzli, Frost, et al., 1976
Bunzli, J.C.; Frost, D.C.; Herring, F.G.; McDowell, C.A.,
Assignment of the doublet states arising from ionization of chlorine lone-pairs in molecules possessing C2v symmetry,
J. Electron Spectrosc. Relat. Phenom., 1976, 9, 289. [all data]
Lacher and Park, 1950
Lacher, J.R.; Park, J.D.,
J. Am. Chem. Soc., 1950, 72, 5486. [all data]
Zenkevich and Rodin, 2004
Zenkevich, I.G.; Rodin, A.A.,
Gas chromatographic identification of some volatile toxic fluorine containing compounds by precalculated retention indices,
J. Ecol. Chem. (Rus.), 2004, 13, 1, 22-28. [all data]
Zenkevich, 1999
Zenkevich, I.G.,
New Application of the Retention Index Concept in Gas and High Performance Liquid Chromatography,
Fresenius' J. Anal. Chem., 1999, 365, 4, 305-309, https://doi.org/10.1007/s002160051491
. [all data]
Zenkevich, 1997
Zenkevich, I.G.,
Influence of the Variations of Dynamics Molecular Parameterts on the Additivity of Chromatigraphic Retention Indices of Products of Organic Reactions Relative to Initial Reagents,
Dokl. Akad. Nauk (Rus.), 1997, 353, 5, 625-627. [all data]
Notes
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- Symbols used in this document:
IE (evaluated) Recommended ionization energy Tboil Boiling point ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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