Thioxanthone
- Formula: C13H8OS
- Molecular weight: 212.267
- IUPAC Standard InChIKey: YRHRIQCWCFGUEQ-UHFFFAOYSA-N
- CAS Registry Number: 492-22-8
- 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: 9H-Thioxanthen-9-one; Thioxanthen-9-one; Thiaxanthenone; Thiaxanthon; Thiaxanthone; Thioxanthene-9-one; Thioxanthene, 9-oxo-; Thioxanthenone; 9-Thioxanthone; 9H-Thioxanthene, 9-oxo-; 10-Thioxanthone; NSC 15912; NSC 658181
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Gas phase thermochemistry data
Go To: Top, Condensed phase thermochemistry data, Phase change data, Gas Chromatography, 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 | 22.5 ± 0.86 | kcal/mol | Ccr | Sabbah and El Watik, 1992 | Published also in Calorim. Anal. Therm. 23,477 1992 |
Condensed phase thermochemistry data
Go To: Top, Gas phase thermochemistry data, Phase change data, Gas Chromatography, 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°solid | -4.90 ± 0.86 | kcal/mol | Ccr | Sabbah and El Watik, 1992 | Published also in Calorim. Anal. Therm. 23,477 1992 |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°solid | -1634.9 ± 0.84 | kcal/mol | Ccr | Sabbah and El Watik, 1992 | Published also in Calorim. Anal. Therm. 23,477 1992 |
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 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 |
---|---|---|---|---|---|
Tfus | 487.88 | K | N/A | Sabbah and Watik, 1992 | Uncertainty assigned by TRC = 0.02 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔsubH° | 27.440 ± 0.098 | kcal/mol | C | Sabbah and El Watik, 1992 | Published also in Calorim. Anal. Therm. 23,477 1992; ALS |
ΔsubH° | 27.44 ± 0.1 | kcal/mol | C | Sabbah and Watik, 1992, 2 | AC |
Reduced pressure boiling point
Tboil (K) | Pressure (atm) | Reference | Comment |
---|---|---|---|
645.2 | 0.941 | Aldrich Chemical Company Inc., 1990 | BS |
Enthalpy of fusion
ΔfusH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
8.4847 | 487.88 | Sabbah and El Watik, 1992, 2 | DH |
8.48 | 487.9 | Sabbah and Watik, 1992, 2 | AC |
Gas Chromatography
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, 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
Normal alkane RI, non-polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | Methyl Silicone | 2049. | Oda, Yasuhara, et al., 1998 | 25. m/0.25 mm/0.25 μm, He; Program: 50 0C (2 min) 20 0C/min -> 160 0C 5 0C/min -> 210 0C 10 0C/min -> 300 0C |
Lee's RI, non-polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | BP-5 | 346.2 | Kelly, Bartle, et al., 1992 | Column length: 25. m; Column diameter: 0.32 mm; Program: XX C X C/min -> 170 C 40 C/min -> 300 C (5 min); Check the values XX and X (bad xerox copy) |
References
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Sabbah and El Watik, 1992
Sabbah, R.; El Watik, L.,
Etude thermodynamique de l'acridone et de la thioxanthone,
Can. J. Chem., 1992, 70, 24-28. [all data]
Sabbah and Watik, 1992
Sabbah, R.; Watik, L.E.,
Can. J. Chem., 1992, 70, 24. [all data]
Sabbah and Watik, 1992, 2
Sabbah, Raphaël; Watik, Lahcen El,
Étude thermodynamique de l'acridone et de la thioxanthone,
Can. J. Chem., 1992, 70, 1, 24-28, https://doi.org/10.1139/v92-005
. [all data]
Aldrich Chemical Company Inc., 1990
Aldrich Chemical Company Inc.,
Catalog Handbook of Fine Chemicals, Aldrich Chemical Company, Inc., Milwaukee WI, 1990, 1. [all data]
Sabbah and El Watik, 1992, 2
Sabbah, R.; El Watik, L.,
Etude thermodynamique de l'aridone et de la thioxanthone,
Calorim. Anal. Therm., 1992, 23, 477-478. [all data]
Oda, Yasuhara, et al., 1998
Oda, J.; Yasuhara, A.; Matsunaga, K.; Saito, Y.,
Identification of polycyclic aromatic hydrocarbons of the particulate accumulated in the tunnel duct of freeway and generation of their oxygenated derivatives,
Jpn. J. Toxicol. Environ. Health, 1998, 44, 5, 334-351, https://doi.org/10.1248/jhs1956.44.334
. [all data]
Kelly, Bartle, et al., 1992
Kelly, G.W.; Bartle, K.D.; Clifford, A.A.; Robinson, R.E.,
Application of coupled LC-GC to the analysis of the polar fraction of diesel particulate matter,
J. Hi. Res. Chromatogr., 1992, 15, 8, 526-530, https://doi.org/10.1002/jhrc.1240150808
. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Gas Chromatography, References
- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) point ΔcH°solid Enthalpy of combustion of solid at standard conditions ΔfH°gas Enthalpy of formation of gas at standard conditions ΔfH°solid Enthalpy of formation of solid at standard conditions ΔfusH Enthalpy of fusion ΔsubH° Enthalpy of sublimation at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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