Phenol, 2,4,6-tribromo-
- Formula: C6H3Br3O
- Molecular weight: 330.799
- IUPAC Standard InChI: InChI=1S/C6H3Br3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H
- IUPAC Standard InChIKey: BSWWXRFVMJHFBN-UHFFFAOYSA-N
- CAS Registry Number: 118-79-6
- 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: Bromkal Pur 3; Bromol; Flammex 3BP; 2,4,6-Tribromophenol; TA 10; Emery 9332; FR-613; Great Lakes PH-73; 1,3,5-Tribromo-2-hydroxybenzene; NSC 2136; TBP; PH 73
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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
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| Tfus | 368.65 | K | N/A | Beringer, Brierley, et al., 1953 | Uncertainty assigned by TRC = 2. K; TRC |
| Tfus | 368. | K | N/A | Timmermans, 1935 | Uncertainty assigned by TRC = 1.5 K; TRC |
| Tfus | 366. | K | N/A | Robertson, 1902 | Uncertainty assigned by TRC = 3. K; TRC |
| Quantity | Value | Units | Method | Reference | Comment |
| ΔsubH° | 23.3 ± 0.26 | kcal/mol | C | Allot and Finch, 1987 | The mean of Heat of formations recomended by author; ALS |
Reduced pressure boiling point
| Tboil (K) | Pressure (atm) | Reference | Comment |
|---|---|---|---|
| 559.2 | 0.982 | Aldrich Chemical Company Inc., 1990 | BS |
Enthalpy of fusion
| ΔfusH (kcal/mol) | Temperature (K) | Reference | Comment |
|---|---|---|---|
| 5.00 | 367.5 | Kuramochi, Maeda, et al., 2004 | AC |
| 4.426 | 366.2 | Acree, 1991 | 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.
Beringer, Brierley, et al., 1953
Beringer, F.M.; Brierley, A.; Drexler, M.; Gindler, E.M.; Lumpkin, C.C.,
Diaryliodonium Salts II. The Phenylation of Organic and Inorganic Bases,
J. Am. Chem. Soc., 1953, 75, 2708. [all data]
Timmermans, 1935
Timmermans, J.,
Researches in Stoichiometry. I. The Heat of Fusion of Organic Compounds.,
Bull. Soc. Chim. Belg., 1935, 44, 17-40. [all data]
Robertson, 1902
Robertson, P.W.,
Atomic and molecular heats of fusion.,
J. Chem. Soc., 1902, 81, 1233. [all data]
Allot and Finch, 1987
Allot, P.H.; Finch, A.,
Enthalpies of formation of 2,4,6-tribromophenol and of 2,4,6-tribromoaniline,
J. Chem. Thermodyn., 1987, 19, 771-779. [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]
Kuramochi, Maeda, et al., 2004
Kuramochi, Hidetoshi; Maeda, Kouji; Kawamoto, Katsuya,
WATER SOLUBILITY AND PARTITIONING BEHAVIOR OF BROMINATED PHENOLS,
Environ Toxicol Chem, 2004, 23, 6, 1386, https://doi.org/10.1897/03-279
. [all data]
Acree, 1991
Acree, William E.,
Thermodynamic properties of organic compounds: enthalpy of fusion and melting point temperature compilation,
Thermochimica Acta, 1991, 189, 1, 37-56, https://doi.org/10.1016/0040-6031(91)87098-H
. [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 at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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