Anthracene, 1,2,3,4,5,6,7,8-octahydro-
- Formula: C14H18
- Molecular weight: 186.2927
- IUPAC Standard InChIKey: LFAYMJXHGYUQNV-UHFFFAOYSA-N
- CAS Registry Number: 1079-71-6
- 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: s-Octahydroanthracene; Octahydroanthracene; 1,2,3,4,5,6,7,8-Octahydroanthracene; sym-Octahydroanthracene; Anthracene, octahydro-
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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
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DRB - Donald R. Burgess, Jr.
DH - Eugene S. Domalski and Elizabeth D. Hearing
CAL - James S. Chickos, William E. Acree, Jr., Joel F. Liebman, Students of Chem 202 (Introduction to the Literature of Chemistry), University of Missouri -- St. Louis
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 567.2 | K | N/A | Weast and Grasselli, 1989 | BS |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 346. | K | N/A | Boyd, Sanwal, et al., 1971 | Uncertainty assigned by TRC = 1. K; TRC |
Tfus | 347. | K | N/A | Smith and Lo, 1948 | Uncertainty assigned by TRC = 6. K; isomer not identified; TRC |
Tfus | 346.4 | K | N/A | Larsen, Thorpe, et al., 1942 | Uncertainty assigned by TRC = 1. K; TRC |
Tfus | 346.15 | K | N/A | Waterman, Leendertse, et al., 1939 | Uncertainty assigned by TRC = 1.5 K; specific isomer not identified; TRC |
Tfus | 347. | K | N/A | Brown, Durand, et al., 1936 | Uncertainty assigned by TRC = 6. K; isomer not identified; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Ttriple | 345.390 | K | N/A | Gammon, Callanan, et al., 1982 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.01 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔsubH° | 82. ± 1. | kJ/mol | V | Boyd, Sanwal, et al., 1971, 2 | ALS |
ΔsubH° | 82.3 | kJ/mol | N/A | Boyd, Sanwal, et al., 1971, 2 | DRB |
ΔsubH° | 82.3 ± 1.2 | kJ/mol | BG | Boyd, Sanwal, et al., 1971, 2 | Based on data from 438. to 499. K. See also Pedley and Rylance, 1977.; AC |
Reduced pressure boiling point
Tboil (K) | Pressure (bar) | Reference | Comment |
---|---|---|---|
440.2 | 0.016 | Weast and Grasselli, 1989 | BS |
Enthalpy of vaporization
ΔvapH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
45.6 | 452. | A | Stephenson and Malanowski, 1987 | Based on data from 437. to 498. K.; AC |
Enthalpy of fusion
ΔfusH (kJ/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
18.34 | 345.4 | Domalski and Hearing, 1996 | AC |
17.910 | 346. | Boyd, Sanwal, et al., 1971, 3 | DH |
Entropy of fusion
ΔfusS (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
51.8 | 346. | Boyd, Sanwal, et al., 1971, 3 | DH |
Entropy of fusion
ΔfusS (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
7.59 | 331.4 | Domalski and Hearing, 1996 | CAL |
53.1 | 345.4 |
Enthalpy of phase transition
ΔHtrs (kJ/mol) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
2.400 | 331.6 | crystaline, II | crystaline, I | Petropavlov, Tsygankova, et al., 1988 | DH |
Entropy of phase transition
ΔStrs (J/mol*K) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
7.2 | 331.6 | crystaline, II | crystaline, I | Petropavlov, Tsygankova, et al., 1988 | DH |
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.
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]
Boyd, Sanwal, et al., 1971
Boyd, R.H.; Sanwal, S.N.; Shary-Tehrany, S.; McNally, D.,
J. Phys. Chem., 1971, 75, 1264. [all data]
Smith and Lo, 1948
Smith, L.I.; Lo, C.P.,
The Jacobsen Reaction IX. 6,7-Dialkyltetralins,
J. Am. Chem. Soc., 1948, 70, 2209. [all data]
Larsen, Thorpe, et al., 1942
Larsen, R.G.; Thorpe, R.E.; Armfield, F.A.,
Oxidation Characteristics of Pure Hydrocarbons,
Ind. Eng. Chem., 1942, 34, 183. [all data]
Waterman, Leendertse, et al., 1939
Waterman, H.I.; Leendertse, J.J.; Cranendenk, A.C.,
Hydrogenation of anthracene and investigation of the resultant products.,
Recl. Trav. Chim. Pays-Bas, 1939, 58, 83. [all data]
Brown, Durand, et al., 1936
Brown, J.H.; Durand, H.W.; Marvel, C.S.,
The Reduction of Aromatic Compounds with Hydrogen and a Platinum Oxide- Platinum Black Catalysis in the Presence of Halogen Acid,
J. Am. Chem. Soc., 1936, 58, 1594. [all data]
Gammon, Callanan, et al., 1982
Gammon, B.E.; Callanan, J.E.; Hossenlopp, I.A.; Osborn, A.G.; Good, W.D.,
Heat Capacitiy, Vapor Pressure and Derived Thermodynamic Properties of Octahydroanthracene
in Proc. Symp. Thermophys. Prop., 8th, 1981, Gaithersburg, Vol. II, Sengers, J. V., Ed., ASME: New York, p 402, 1982. [all data]
Boyd, Sanwal, et al., 1971, 2
Boyd, R.H.; Sanwal, S.N.; Shary-Tehrany, S.; McNally, D.,
The thermochemistry, thermodynamic functions, and molecular structures of some cyclic hydrocarbons,
J. Phys. Chem., 1971, 75, 1264-1271. [all data]
Pedley and Rylance, 1977
Pedley, J.B.; Rylance, J.,
, Computer Analysed Thermochemical Data: Organic and Organometallic Compounds, University of Sussex, Brighton, 1977. [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]
Domalski and Hearing, 1996
Domalski, Eugene S.; Hearing, Elizabeth D.,
Heat Capacities and Entropies of Organic Compounds in the Condensed Phase. Volume III,
J. Phys. Chem. Ref. Data, 1996, 25, 1, 1, https://doi.org/10.1063/1.555985
. [all data]
Boyd, Sanwal, et al., 1971, 3
Boyd, R.H.; Sanwal, S.N.; Shary-Tehrany, S.; McNally, D.,
The thermochemistry, thermodynamic functions, and molecular structures of some cyclic hydrocarbons,
J. Phys. Chem., 1971, 75, 1265-1271. [all data]
Petropavlov, Tsygankova, et al., 1988
Petropavlov, N.N.; Tsygankova, I.G.; Teslenko, L.A.,
Microcalorimetric investigation of polymorphic transitions in organic crystals,
Sov. Phys. Crystallogr., 1988, 33(6), 853-855. [all data]
Notes
Go To: Top, Phase change data, References
- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) point Ttriple Triple point temperature ΔHtrs Enthalpy of phase transition ΔStrs Entropy of phase transition ΔfusH Enthalpy of fusion ΔfusS Entropy of fusion ΔsubH° Enthalpy of sublimation at standard conditions ΔvapH Enthalpy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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