1-Butanamine, N,N-dimethyl-
- Formula: C6H15N
- Molecular weight: 101.1900
- IUPAC Standard InChIKey: DJEQZVQFEPKLOY-UHFFFAOYSA-N
- CAS Registry Number: 927-62-8
- 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: Butylamine, N,N-dimethyl-; Butyldimethylamine; Dimethylbutylamine; N,N-Dimethylbutylamine; n-C4H9N(CH3)2; N,N-Dimethyl-n-butylamine; N-n-Butyldimethylamine; N,N-Dimethyl-1-butanamine; 1-(N,N-Dimethylamino)butane
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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
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 366. | K | N/A | American Tokyo Kasei, 1988 | BS |
Tboil | 366.65 | K | N/A | Gautier, Renault, et al., 1957 | Uncertainty assigned by TRC = 3. K; TRC |
Tboil | 363.15 | K | N/A | Engelhardt, 1956 | Uncertainty assigned by TRC = 3. K; TRC |
Tboil | 365.65 | K | N/A | Anonymous, 1952 | Uncertainty assigned by TRC = 5. K; TRC |
Tboil | 366.65 | K | N/A | Amundsen and Pitts, 1951 | Uncertainty assigned by TRC = 3. K; TRC |
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 evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias
Data compiled as indicated in comments:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Proton affinity (review) | 231.6 | kcal/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 224.2 | kcal/mol | N/A | Hunter and Lias, 1998 | HL |
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
8.35 | PE | Nelsen, 1984 | Vertical value; LBLHLM |
Appearance energy determinations
Ion | AE (eV) | Other Products | Method | Reference | Comment |
---|---|---|---|---|---|
C2H6N+ | 9.75 ± 0.10 | C4H9 | EI | Solka and Russell, 1974 | LLK |
Mass spectrum (electron ionization)
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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
Spectrum
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Additional Data
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Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | Japan AIST/NIMC Database- Spectrum MS-NW-1254 |
NIST MS number | 233692 |
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 | Apiezon L | 80. | 696. | Zhuravleva, Golovnya, et al., 1981 | Chromosorb G AW (80-100 mesh); Column length: 2.7 m |
Packed | Apiezon L | 80. | 676.3 | Zhuravleva, Golovnya, et al., 1981 | Chromosorb G AW (80-100 mesh); Column length: 2.7 m |
Packed | Apiezon | 100. | 696. | Golovnya, Zhuravleva, et al., 1976 | Column length: 2.7 m |
Normal alkane RI, non-polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | Methyl Silicone | 697. | Zenkevich, 1999 | Program: not specified |
References
Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), Gas Chromatography, NIST Subscription Links, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
American Tokyo Kasei, 1988
American Tokyo Kasei,
TCI American Organic Chemical 88/89 Catalog, American Tokyo Kasei, Portland, OR, 1988, 1610. [all data]
Gautier, Renault, et al., 1957
Gautier; Renault; Rabiant,
Bull. Soc. Chim. Fr., 1957, 1957, 1014. [all data]
Engelhardt, 1956
Engelhardt, V.A.,
Allenic and Acetylenic Amines for Vinylacetylene,
J. Am. Chem. Soc., 1956, 78, 107. [all data]
Anonymous, 1952
Anonymous, P.,
, 1952. [all data]
Amundsen and Pitts, 1951
Amundsen, L.H.; Pitts, L.S.,
J. Am. Chem. Soc., 1951, 73, 1494. [all data]
Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G.,
Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update,
J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018
. [all data]
Nelsen, 1984
Nelsen, S.F.,
Ionization from nitrogen and oxygen lone pairs: A comparison of trialkylamine, dialkyl ether, tetraalkylhydrazine, and dialkyl peroxide photoelectron spectroscopic ionization potentials,
J. Org. Chem., 1984, 49, 1891. [all data]
Solka and Russell, 1974
Solka, B.H.; Russell, M.E.,
Energetics of formation of some structural isomers of gaseous C2H5O+ C2H6N+ ions,
J. Phys. Chem., 1974, 78, 1268. [all data]
Zhuravleva, Golovnya, et al., 1981
Zhuravleva, I.L.; Golovnya, R.V.; Terenina, M.B.; Grigorieva, D.N.,
Gas chromatographic behaviour of some unsymmetrical tertiary amines,
Zh. Anal. Khim., 1981, 36, 968-975. [all data]
Golovnya, Zhuravleva, et al., 1976
Golovnya, R.V.; Zhuravleva, I.L.; Kapustin, Yu.P.,
Gas chromatographic separation of tertiary isoaliphatic amines on supports treated with trisodium phosphate,
Zh. Anal. Khim., 1976, 31, 764-768. [all data]
Zenkevich, 1999
Zenkevich, I.G.,
Dependence of Gas Chromatographic Retention Indices on Dynamics Molecular Characteristics,
Zh. Fiz. Khim., 1999, 73, 5, 905-910. [all data]
Notes
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- Symbols used in this document:
AE Appearance energy Tboil Boiling point - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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