Butane, 2-nitro-
- Formula: C4H9NO2
- Molecular weight: 103.1198
- IUPAC Standard InChIKey: SUGZATOHBPXTDV-UHFFFAOYSA-N
- CAS Registry Number: 600-24-8
- Chemical structure:
This structure is also available as a 2d Mol file - Species with the same structure:
- Other names: 2-Nitrobutane; sec-C4H9NO2
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Phase change data
Go To: Top, Gas phase ion energetics data, Gas Chromatography, References, Notes
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:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 412.8 | K | N/A | Hodge, 1940 | Uncertainty assigned by TRC = 0.7 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 412.65 | K | N/A | Toops, 1956 | Uncertainty assigned by TRC = 0.07 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 43.85 ± 0.42 | kJ/mol | V | Holcomb and Dorsey, 1949 | ALS |
Enthalpy of vaporization
ΔvapH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
40.3 | 360. | A,EB | Stephenson and Malanowski, 1987 | Based on data from 345. to 413. K. See also Toops, 1956, 2 and Dykyj, 1971.; AC |
Gas phase ion energetics 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:
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
10.71 ± 0.01 | PE | Dewar, Shanshal, et al., 1969 | RDSH |
Gas Chromatography
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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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Kovats' RI, non-polar column, isothermal
Column type | Active phase | Temperature (C) | I | Reference | Comment |
---|---|---|---|---|---|
Packed | SF-96 | 100. | 776. | Boneva and Dimov, 1979 | N2; Column length: 2. m |
Packed | SF-96 | 110. | 776. | Boneva and Dimov, 1979 | N2; Column length: 2. m |
Packed | SF-96 | 90. | 774. | Boneva and Dimov, 1979 | N2; Column length: 2. m |
References
Go To: Top, Phase change data, Gas phase ion energetics data, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Hodge, 1940
Hodge, E.B.,
Vapor pressures for six aliphatic nitro compounds,
Ind. Eng. Chem., 1940, 32, 748. [all data]
Toops, 1956
Toops, E.E.,
Physical Properties of High Purity Nitroparaffins,
J. Phys. Chem., 1956, 60, 304-6. [all data]
Holcomb and Dorsey, 1949
Holcomb, D.E.; Dorsey, C.L., Jr.,
Thermodynamic properties of nitroparaffins,
Ind. Eng. Chem., 1949, 41, 2788-2792. [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]
Toops, 1956, 2
Toops, Emory E.,
Physical Properties of Eight High-Purity Nitroparaffins,
J. Phys. Chem., 1956, 60, 3, 304-306, https://doi.org/10.1021/j150537a012
. [all data]
Dykyj, 1971
Dykyj, J.,
Petrochemia, 1971, 11, 2, 27. [all data]
Dewar, Shanshal, et al., 1969
Dewar, M.J.S.; Shanshal, M.; Worley, S.D.,
Calculated and observed ionization potentials gf nitroalkanes and of nitrous and nitric acids and esters. Extension of the MINDO method to nitrogen-oxygen compounds,
J. Am. Chem. Soc., 1969, 91, 3590. [all data]
Boneva and Dimov, 1979
Boneva, S.; Dimov, N.,
Chromatographic retention indices of C1-C4 nitroparaffins,
Zh. Anal. Khim., 1979, 34, 6, 902-905. [all data]
Notes
Go To: Top, Phase change data, Gas phase ion energetics data, Gas Chromatography, References
- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) 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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