1,3-Butadiene, 1,4-diphenyl-, (E,E)-
- Formula: C16H14
- Molecular weight: 206.2824
- IUPAC Standard InChI: InChI=1S/C16H14/c1-3-9-15(10-4-1)13-7-8-14-16-11-5-2-6-12-16/h1-14H/b13-7+,14-8+
- IUPAC Standard InChIKey: JFLKFZNIIQFQBS-FNCQTZNRSA-N
- CAS Registry Number: 538-81-8
- 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. - Stereoisomers:
- Other names: trans,trans-1,4-Diphenyl-1,3-butadiene; (E,E)-(C6H5CH=CH)2; (E,E)-1,4-Diphenyl-1,3-butadiene; trans,trans-1,4-Diphenylbutadiene; Benzene, 1,1'-(1,3-butadiene-1,4-diyl)bis-, (E,E)-; 1,3-Butadiene, 1,4-diphenyl-, trans,trans-; 1,4-Diphenyl-trans-1,trans-3-butadiene; 1,4-Diphenyl-1,3-butadiene, trans,trans-; (E,E)-1,4-Diphenylbutadiene; all-trans-Diphenylbutadiene; [(1E,3E)-4-Phenyl-1,3-butadienyl]benzene; (1E,4E)-1,4-Diphenyl-1,3-butadiene; (E,E)-(c6H5Ch=ch2)2
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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
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| Tboil | 623.2 | K | N/A | Aldrich Chemical Company Inc., 1990 | BS |
| Quantity | Value | Units | Method | Reference | Comment |
| Tfus | 421.4 | K | N/A | Berry, Lipsky, et al., 1956 | Uncertainty assigned by TRC = 0.7 K; TRC |
| Tfus | 423.7 | K | N/A | Dombrovsky and Terent'ev, 1956 | Uncertainty assigned by TRC = 2. K; TRC |
| Tfus | 425.9 | K | N/A | Cram and Steinberg, 1951 | Uncertainty assigned by TRC = 4. K; TRC |
| Tfus | 426.4 | K | N/A | Hofer and Peebles, 1951 | Uncertainty assigned by TRC = 2. K; TRC |
Enthalpy of sublimation
| ΔsubH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
|---|---|---|---|---|
| 39.7 ± 1.6 | 293. | V | Coates and Sutton, 1948 | Reanalyzed by Cox and Pilcher, 1970, Original value = 22.3 ± 0.5 kcal/mol; ALS |
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.
Aldrich Chemical Company Inc., 1990
Aldrich Chemical Company Inc.,
Catalog Handbook of Fine Chemicals, Aldrich Chemical Company, Inc., Milwaukee WI, 1990, 1. [all data]
Berry, Lipsky, et al., 1956
Berry, P.J.; Lipsky, S.; Burton, M.,
Radiation-Induced Luminescence Part 2 - The Effect of Oxygen and Bromobenzene,
Trans. Faraday Soc., 1956, 52, 311. [all data]
Dombrovsky and Terent'ev, 1956
Dombrovsky, A.V.; Terent'ev, A.P.,
Haloarylation of Undaturated Compounds with Aromatic Diazo Compounds I. Reaction of Phenyldiazonium Chloride and Bromidw with 1,3-Butadiene and Some Transformations of 4-Chloro-1-phenyl-2-butene,
Zh. Obshch. Khim., 1956, 26, 2776-82. [all data]
Cram and Steinberg, 1951
Cram, D.J.; Steinberg, H.,
J. Am. Chem. Soc., 1951, 73, 5691. [all data]
Hofer and Peebles, 1951
Hofer, L.J.; Peebles, W.C.,
X-Ray Diffraction Patterns of Solid Aromatic Hydrocarbons,
Anal. Chem., 1951, 23, 690. [all data]
Coates and Sutton, 1948
Coates, G.E.; Sutton, L.E.,
The heats of formation of the -N=N- and >C=N- bonds,
J. Chem. Soc., 1948, 1187-1196. [all data]
Cox and Pilcher, 1970
Cox, J.D.; Pilcher, G.,
Thermochemistry of Organic and Organometallic Compounds, Academic Press, New York, 1970, 1-636. [all data]
Notes
Go To: Top, Phase change data, References
- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) point ΔsubH Enthalpy of sublimation - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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