Propane, 2-methyl-2-nitro-
- Formula: C4H9NO2
- Molecular weight: 103.1198
- IUPAC Standard InChI: InChI=1S/C4H9NO2/c1-4(2,3)5(6)7/h1-3H3
- IUPAC Standard InChIKey: AIMREYQYBFBEGQ-UHFFFAOYSA-N
- CAS Registry Number: 594-70-7
- 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: Trimethylnitromethane; 1,1-Dimethyl-1-nitroethane; 2-Methyl-2-nitropropane; 2-Nitro-2-methylpropane; 2-Nitroisobutane; (CH3)3CNO2; tert-Nitrobutane; nitro-tert-butane
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Gas phase thermochemistry data
Go To: Top, Condensed phase thermochemistry 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔfH°gas | -177.1 ± 3.3 | kJ/mol | Ccb | Knobel, Miroshnichenko, et al., 1970 | Reanalyzed by Pedley, Naylor, et al., 1986, Original value = -177. kJ/mol; Heat of Vaporization=9.6±0.1 kcal/mol |
Condensed phase thermochemistry data
Go To: Top, Gas phase thermochemistry 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔfH°solid | -230. ± 3. | kJ/mol | Ccb | Knobel, Miroshnichenko, et al., 1970 | Heat of Vaporization=9.6±0.1 kcal/mol |
| Quantity | Value | Units | Method | Reference | Comment |
| ΔcH°solid | -2630. ± 3. | kJ/mol | Ccb | Knobel, Miroshnichenko, et al., 1970 | Heat of Vaporization=9.6±0.1 kcal/mol |
References
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Knobel, Miroshnichenko, et al., 1970
Knobel, Yu.K.; Miroshnichenko, E.A.; Lebedev, Yu.A.,
Heat of combustion of 2-methyl-2-nitropropane and dissociation of C - N bond in mononitro derovatoves of propane and butane,
Dokl. Phys. Chem. (Engl. Transl.), 1970, 190, 45-47, In original 348. [all data]
Pedley, Naylor, et al., 1986
Pedley, J.B.; Naylor, R.D.; Kirby, S.P.,
Thermochemical Data of Organic Compounds, Chapman and Hall, New York, 1986, 1-792. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, References
- Symbols used in this document:
ΔcH°solid Enthalpy of combustion of solid at standard conditions ΔfH°gas Enthalpy of formation of gas at standard conditions ΔfH°solid Enthalpy of formation of solid at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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