Ethanone, 1-(3-thienyl)-
- Formula: C6H6OS
- Molecular weight: 126.176
- IUPAC Standard InChI: InChI=1S/C6H6OS/c1-5(7)6-2-3-8-4-6/h2-4H,1H3
- IUPAC Standard InChIKey: RNIDWJDZNNVFDY-UHFFFAOYSA-N
- CAS Registry Number: 1468-83-3
- 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: Ketone, methyl 3-thienyl; 3-Acetylthiophene; Methyl 3-thienyl ketone
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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 as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| Tfus | 334. to 335. | K | N/A | Buckingham and Donaghy, 1982 | BS |
Reduced pressure boiling point
| Tboil (K) | Pressure (bar) | Reference | Comment |
|---|---|---|---|
| 482.2 | 0.997 | Weast and Grasselli, 1989 | BS |
| 351. to 352. | 0.007 | Buckingham and Donaghy, 1982 | BS |
Enthalpy of fusion
| ΔfusH (kJ/mol) | Temperature (K) | Reference | Comment |
|---|---|---|---|
| 18.9 | 333.6 | Temprado, Roux, et al., 2006 | AC |
References
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Buckingham and Donaghy, 1982
Buckingham, J.; Donaghy, S.M.,
Dictionary of Organic Compounds: Fifth Edition, Chapman and Hall, New York, 1982, 1. [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]
Temprado, Roux, et al., 2006
Temprado, Manuel; Roux, Maria Victoria; Jiménez, Pilar; Guzmán-Mejía, Ramón; Juaristi, Eusebio,
Thermophysical properties of sulfur heterocycles: Thiane and thiophene derivatives,
Thermochimica Acta, 2006, 441, 1, 20-26, https://doi.org/10.1016/j.tca.2005.11.024
. [all data]
Notes
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- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) point ΔfusH Enthalpy of fusion - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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