Cyclotrisiloxane, hexaethyl-
- Formula: C12H30O3Si3
- Molecular weight: 306.6213
- IUPAC Standard InChIKey: KMPBCFZCRNKXSA-UHFFFAOYSA-N
- CAS Registry Number: 2031-79-0
- 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: Hexaethylcyclotrisiloxane; 1,1,3,3,5,5-Hexaethylcyclotrisiloxane
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Phase change data
Go To: Top, 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:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Ttriple | 283.41 | K | N/A | Lebedev, Kulagina, et al., 1988 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.02 K; TRC |
Ttriple | 280.2 | K | N/A | Dzhafarov and Kuliev, 1985 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.1 K; TRC |
Ttriple | 283.24 | K | N/A | Lebedev, Kulagina, et al., 1984 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.02 K; TRC |
Ttriple | 283.41 | K | N/A | Kulagina and Lebedev, 1982 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.02 K; TRC |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
13.8 | 400. | A | Stephenson and Malanowski, 1987 | Based on data from 385. to 524. K.; AC |
14.0 | 449. | A | Stephenson and Malanowski, 1987 | Based on data from 434. to 516. K. See also Jenkins and Chambers, 1954.; 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 |
---|---|---|---|---|
434.7 to 516.0 | 3.50236 | 1276. | -159. | Jenkins and Chambers, 1954 |
Enthalpy of fusion
ΔfusH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
2.729 | 280.2 | Domalski and Hearing, 1990 | AC |
Enthalpy of phase transition
ΔHtrs (kcal/mol) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
0.1123 | 140. to 168. | crystaline, III | crystaline, II | Lebedev, Kulagina, et al., 1988, 2 | DH |
2.80373 | 242.4 | crystaline, II | crystaline, I | Lebedev, Kulagina, et al., 1988, 2 | DH |
2.85380 | 283.41 | crystaline, I | liquid | Lebedev, Kulagina, et al., 1988, 2 | DH |
0.110 | 160. | crystaline, III | crystaline, II | Dzhafarov and Kuliev, 1985, 2 | DH |
2.8260 | 242.3 | crystaline, II | crystaline, I | Dzhafarov and Kuliev, 1985, 2 | DH |
2.7304 | 280.2 | crystaline, I | liquid | Dzhafarov and Kuliev, 1985, 2 | DH |
0.112 | 130. | crystaline, III | crystaline, II | Kulagina and Lebedev, 1982, 2 | Glassy transition.; DH |
2.8035 | 242.3 | crystaline, II | crystaline, I | Kulagina and Lebedev, 1982, 2 | DH |
2.8537 | 283.41 | crystaline, I | liquid | Kulagina and Lebedev, 1982, 2 | DH |
Entropy of phase transition
ΔStrs (cal/mol*K) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
0.497 | 140. to 168. | crystaline, III | crystaline, II | Lebedev, Kulagina, et al., 1988, 2 | DH |
11.57 | 242.4 | crystaline, II | crystaline, I | Lebedev, Kulagina, et al., 1988, 2 | DH |
10.05 | 283.41 | crystaline, I | liquid | Lebedev, Kulagina, et al., 1988, 2 | DH |
0.69 | 160. | crystaline, III | crystaline, II | Dzhafarov and Kuliev, 1985, 2 | DH |
11.7 | 242.3 | crystaline, II | crystaline, I | Dzhafarov and Kuliev, 1985, 2 | DH |
9.78 | 280.2 | crystaline, I | liquid | Dzhafarov and Kuliev, 1985, 2 | DH |
0.863 | 130. | crystaline, III | crystaline, II | Kulagina and Lebedev, 1982, 2 | Glassy; DH |
11.57 | 242.3 | crystaline, II | crystaline, I | Kulagina and Lebedev, 1982, 2 | DH |
Mass spectrum (electron ionization)
Go To: Top, Phase change 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
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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. |
---|---|
Origin | RADIAN CORP |
NIST MS number | 73288 |
References
Go To: Top, Phase change 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.
Lebedev, Kulagina, et al., 1988
Lebedev, B.V.; Kulagina, T.G.; Smirnova, N.N.,
Thermodynamics of 4-methylcyclohexene, glycollide, and 1,1,3,3,5,5-hexaethylcyclotrisiloxane from 13.4 to 400 K,
J. Chem. Thermodyn., 1988, 20, 1383. [all data]
Dzhafarov and Kuliev, 1985
Dzhafarov, O.I.; Kuliev, A.M.,
Specific heat, phase transitions and thermodynamic properties of 1,1,3,3,5,5-hexaethylcyclotrisiloxane in the range 5-300 K,
Zh. Fiz. Khim., 1985, 59, 308-12. [all data]
Lebedev, Kulagina, et al., 1984
Lebedev, B.V.; Kulagina, T.G.; Svistunov, V.S.; Papkov, V.S.; Zhdanov, A.A.,
Calorimetric study of 1,1,3,3,5,5-hexaethylcyclotrisiloxane and polydi-ethylsiloxane and the process of polymerization of 1,1,3,3,5,5-hexaethyl- cyclotrisiloxane in the range 13-330 K.,
Vysokomol. Soedin., Ser. A, 1984, 26, 2476-82. [all data]
Kulagina and Lebedev, 1982
Kulagina, T.G.; Lebedev, B.V.,
Thermodynamics of 2,2,4,4,6,6-hexaethylcyclotrisiloxane, its polymerization and resulting poly(diethylsiloxane) in the 0-300 K range,
Termodin. Org. Soedin., 1982, 1982, 18-26. [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]
Jenkins and Chambers, 1954
Jenkins, Arthur C.; Chambers, George F.,
Vapor Pressures of Silicon Compounds,
Ind. Eng. Chem., 1954, 46, 11, 2367-2369, https://doi.org/10.1021/ie50539a043
. [all data]
Domalski and Hearing, 1990
Domalski, Eugene S.; Hearing, Elizabeth D.,
Heat Capacities and Entropies of Organic Compounds in the Condensed Phase Volume II,
J. Phys. Chem. Ref. Data, 1990, 19, 4, 881, https://doi.org/10.1063/1.555876
. [all data]
Lebedev, Kulagina, et al., 1988, 2
Lebedev, B.V.; Kulagina, T.G.; Smirnova, N.N.,
Thermodynamics of 4-methylcyclo-hexene, glycollide, and 1,1,3,3,5,5-hexaethylcyclotrisiloxane from 13.4 to 400 K,
J. Chem. Thermodyn., 1988, 20, 1383-1396. [all data]
Dzhafarov and Kuliev, 1985, 2
Dzhafarov, O.I.; Kuliev, A.M.,
Specific heat, phase transitions and thermodynamic properties of 1,1,3,3,5,5-hexaethylcyclotrisiloxane in the range 5-300 K,
Zhur. Fiz. Khim., 1985, 59, 308-312. [all data]
Kulagina and Lebedev, 1982, 2
Kulagina, T.G.; Lebedev, B.V.,
Thermodynamics of 2,2,4,4,6,6-hexaethylcyclotrisiloxane, its polymerization,
and the resulting poly(diethylsiloxane) in the 0-330 K range, 1982, Termodin. [all data]
Notes
Go To: Top, Phase change data, Mass spectrum (electron ionization), References
- Symbols used in this document:
Ttriple Triple point temperature ΔHtrs Enthalpy of phase transition ΔStrs Entropy of phase transition ΔfusH Enthalpy of fusion ΔvapH Enthalpy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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