Hexane, 1-methoxy-
- Formula: C7H16O
- Molecular weight: 116.2013
- IUPAC Standard InChI: InChI=1S/C7H16O/c1-3-4-5-6-7-8-2/h3-7H2,1-2H3
- IUPAC Standard InChIKey: ICBJCVRQDSQPGI-UHFFFAOYSA-N
- CAS Registry Number: 4747-07-3
- 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: Ether, hexyl methyl; Hexyl methyl ether; Methyl hexyl ether; 1-Methoxyhexane
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Phase change data
Go To: Top, Gas phase ion energetics data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| Tboil | 399.2 | K | N/A | Majer and Svoboda, 1985 | |
| Quantity | Value | Units | Method | Reference | Comment |
| ΔvapH° | 42.1 | kJ/mol | N/A | Majer and Svoboda, 1985 |
Enthalpy of vaporization
| ΔvapH (kJ/mol) | Temperature (K) | Reference |
|---|---|---|
| 34.93 | 399.2 | Majer and Svoboda, 1985 |
Gas phase ion energetics data
Go To: Top, Phase change data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: Sharon G. Lias and Joel F. Liebman
Ionization energy determinations
| IE (eV) | Method | Reference |
|---|---|---|
| ≤9.48 | PI | Ahmmed, Hudson, et al., 1990 |
Appearance energy determinations
| Ion | AE (eV) | Other Products | Method | Reference | Comment |
|---|---|---|---|---|---|
| CH5O+ | 9.63 | C5H8CH3 | PI | Ahmmed, Hudson, et al., 1990 | |
| C6H12+ | 9.61 | CH3OH | PI | Ahmmed, Hudson, et al., 1990 |
References
Go To: Top, Phase change data, Gas phase ion energetics data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Majer and Svoboda, 1985
Majer, V.; Svoboda, V.,
Enthalpies of Vaporization of Organic Compounds: A Critical Review and Data Compilation, Blackwell Scientific Publications, Oxford, 1985, 300. [all data]
Ahmmed, Hudson, et al., 1990
Ahmmed, M.S.; Hudson, C.E.; Traeger, J.C.; Giam, C.S.; McAdoo, D.J.,
ROH2+ formation from ionized n-hexyl ethers: An unequivocal dissocation through an ion-neutral complex in the gas phase,
J. Am. Chem. Soc., 1990, 112, 6443. [all data]
Notes
Go To: Top, Phase change data, Gas phase ion energetics data, References
- Symbols used in this document:
AE Appearance energy Tboil Boiling point ΔvapH Enthalpy of vaporization ΔvapH° Enthalpy of vaporization at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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