Acetophenone, 4'-hydroxy-
- Formula: C8H8O2
- Molecular weight: 136.1479
- IUPAC Standard InChIKey: TXFPEBPIARQUIG-UHFFFAOYSA-N
- CAS Registry Number: 99-93-4
- 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: Ethanone, 1-(4-hydroxyphenyl)-; p-Hydroxyacetophenone; p-Hydroxyphenyl methyl ketone; p-Oxyacetophenone; Methyl p-hydroxyphenyl ketone; Phenol, p-acetyl-; Piceol; 1-(4-Hydroxyphenyl)ethanone; 4'-Hydroxyacetophenone; para-Hydroxyacetophenone; 4-Hydroxyacetophenone; Acetophenone, p-hydroxy-; Hydroxyacetophenone, para; USAF KF-15; p-Acetylphenol; 4-Acetylphenol; 4-Hydroksyacetofenol; NSC 3698
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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
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tfus | 311. | K | N/A | Dauben and Collette, 1959 | Uncertainty assigned by TRC = 3. K; TRC |
Tfus | 383. | K | N/A | Simons, Randall, et al., 1939 | Uncertainty assigned by TRC = 2. K; TRC |
Tfus | 379.65 | K | N/A | Coulthard, Marshall, et al., 1930 | Uncertainty assigned by TRC = 2. K; TRC |
Reduced pressure boiling point
Tboil (K) | Pressure (bar) | Reference | Comment |
---|---|---|---|
420.7 | 0.004 | Weast and Grasselli, 1989 | BS |
Enthalpy of sublimation
ΔsubH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
95.7 | 335. | A | Stephenson and Malanowski, 1987 | Based on data from 320. to 349. K. See also Aihara, 1960.; AC |
Enthalpy of fusion
ΔfusH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
18.08 | 382.8 | N/A | Bernardes, Piedade, et al., 2008 | AC |
17.0 | 381.3 | DSC | Chen, Tang, et al., 2005 | AC |
References
Go To: Top, Phase change data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Dauben and Collette, 1959
Dauben, W.G.; Collette, J.W.,
An Abnormal Reaction of an Organocadmium Reagent: para-Acylation of m-Methoxythenylcadmium Reagent,
J. Am. Chem. Soc., 1959, 81, 967-72. [all data]
Simons, Randall, et al., 1939
Simons, J.H.; Randall, D.I.; Archer, S.,
Hydrogen Fluoride as A Condensing Agent VI. The Acylaction of Aromatic Compounds,
J. Am. Chem. Soc., 1939, 61, 1795. [all data]
Coulthard, Marshall, et al., 1930
Coulthard, C.E.; Marshall, J.; Pyman, F.L.,
The Variation of Phenol Coefficients in a Homologous Series of Phenols,
J. Chem. Soc., 1930, 1930, 280. [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]
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]
Aihara, 1960
Aihara, Ariyuki,
Estimation of the Energy of Hydrogen Bonds Formed in Crystals. II. Phenols,
Bull. Chem. Soc. Jpn., 1960, 33, 2, 194-200, https://doi.org/10.1246/bcsj.33.194
. [all data]
Bernardes, Piedade, et al., 2008
Bernardes, Carlos E.S.; Piedade, M. Fátima M.; Piedade, Manuel E. Minas da,
Polymorphism in 4´-Hydroxyacetophenone: Structure and Energetics,
Crystal Growth & Design, 2008, 8, 7, 2419-2430, https://doi.org/10.1021/cg7012792
. [all data]
Chen, Tang, et al., 2005
Chen, Yan-Ping; Tang, Muoi; Kuo, Ju-Chia,
Solid--liquid equilibria for binary mixtures of N-phenylacetamide with 4-aminoacetophenone, 3-hydroxyacetophenone and 4-hydroxyacetophenone,
Fluid Phase Equilibria, 2005, 232, 1-2, 182-188, https://doi.org/10.1016/j.fluid.2005.03.023
. [all data]
Notes
Go To: Top, Phase change data, References
- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) point ΔfusH Enthalpy of fusion ΔsubH Enthalpy of sublimation - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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