Bicyclo[2.2.1]heptane, 2-methyl-, exo-
- Formula: C8H14
- Molecular weight: 110.1968
- IUPAC Standard InChI: InChI=1S/C8H14/c1-6-4-7-2-3-8(6)5-7/h6-8H,2-5H2,1H3/t6-,7?,8?/m1/s1
- IUPAC Standard InChIKey: KWSARSUDWPZTFF-JECWYVHBSA-N
- CAS Registry Number: 872-78-6
- 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. - Stereoisomers:
- Other names: Norbornane, 2-methyl-, exo-; exo-2-Methylbicyclo[2.2.1]heptane; exo-2-Methylnorbornane; exo-2-methylbicyclo-(2,2,1)-heptane
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Condensed phase thermochemistry 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:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔfH°liquid | -122.5 ± 1.2 | kJ/mol | Ccb | Kozina, 1976 | ALS |
| Quantity | Value | Units | Method | Reference | Comment |
| ΔcH°liquid | -5026.4 ± 1.1 | kJ/mol | Ccb | Kozina, 1976 | Corresponding ΔfHºliquid = -122.4 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS |
| Quantity | Value | Units | Method | Reference | Comment |
| S°liquid | 246.2 | J/mol*K | N/A | Seregin, Goroshko, et al., 1964 | DH |
Constant pressure heat capacity of liquid
| Cp,liquid (J/mol*K) | Temperature (K) | Reference | Comment |
|---|---|---|---|
| 185.8 | 298.15 | Seregin, Goroshko, et al., 1964 | T = 12 to 310 K.; DH |
Reaction thermochemistry 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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.
Individual Reactions
2 +
=
By formula: 2H2 + C8H10 = C8H14
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | -313. ± 0.4 | kJ/mol | Chyd | Roth, Adamczak, et al., 1991 | liquid phase |
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.
Kozina, 1976
Kozina, M.P.,
Enthalpies of combustion and formation of bicyclic and polycyclic hydrocarbons,
Sovrem. Probl. Fiz. Khim., 1976, 9, 198-225. [all data]
Seregin, Goroshko, et al., 1964
Seregin, E.A.; Goroshko, N.N.; Kolesov, V.P.; Belikova, N.A.; Skuratov, S.M.; Plate, A.F.,
Low temperature heat capacity and thermodynamic functions for endo- and exo-2-methylbicyclo[2,2,1]heptane,
Dokl. Akad. Nauk, 1964, SSR 159, 1381-1384. [all data]
Roth, Adamczak, et al., 1991
Roth, W.R.; Adamczak, O.; Breuckmann, R.; Lennartz, H.-W.; Boese, R.,
Die Berechnung von Resonanzenergien; das MM2ERW-Kraftfeld,
Chem. Ber., 1991, 124, 2499-2521. [all data]
Notes
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- Symbols used in this document:
Cp,liquid Constant pressure heat capacity of liquid S°liquid Entropy of liquid at standard conditions ΔcH°liquid Enthalpy of combustion of liquid at standard conditions ΔfH°liquid Enthalpy of formation of liquid at standard conditions ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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