5-Undecyne
- Formula: C11H20
- Molecular weight: 152.2765
- IUPAC Standard InChIKey: VRQLDBSWBBKOCR-UHFFFAOYSA-N
- CAS Registry Number: 2294-72-6
- 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. - Other names: 5-C11H20
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Phase change data
Go To: Top, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), 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:
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 | 471. | K | N/A | Farchan Laboratories, 1990 | BS |
Tboil | 471.2 | K | N/A | Weast and Grasselli, 1989 | BS |
Tboil | 469. | K | N/A | Truchet, 1931 | Uncertainty assigned by TRC = 2. K; TRC |
Tboil | 469. | K | N/A | Truchet, 1930 | Uncertainty assigned by TRC = 2. K; TRC |
Reduced pressure boiling point
Tboil (K) | Pressure (bar) | Reference | Comment |
---|---|---|---|
351. | 0.013 | Farchan Laboratories, 1990 | BS |
351.5 | 0.013 | Weast and Grasselli, 1989 | BS |
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:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
9.11 ± 0.02 | PI | Rang and Martinson, 1978 | LLK |
IR Spectrum
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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
Gas Phase Spectrum
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Additional Data
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Owner | NIST Standard Reference Data Program Collection (C) 2018 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | NIST Mass Spectrometry Data Center |
State | gas |
Instrument | HP-GC/MS/IRD |
Mass spectrum (electron ionization)
Go To: Top, Phase change data, Gas phase ion energetics data, IR Spectrum, 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 by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
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Due to licensing restrictions, this spectrum cannot be downloaded.
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 | D.HENNEBERG, MAX-PLANCK INSTITUTE, MULHEIM, WEST GERMANY |
NIST MS number | 61699 |
Gas Chromatography
Go To: Top, Phase change data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), 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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Kovats' RI, non-polar column, isothermal
Column type | Active phase | Temperature (C) | I | Reference | Comment |
---|---|---|---|---|---|
Capillary | Squalane | 80. | 1104. | Soják, Farkas, et al., 1991 | 107. m/0.25 mm/0.40 μm, H2 |
Capillary | OV-101 | 110. | 1127. | Kuningas, Rang, et al., 1990 | He; Column length: 50. m; Column diameter: 0.25 mm |
Capillary | Squalane | 110. | 1104. | Rang, Kuningas, et al., 1976 | N2; Column length: 100. m; Column diameter: 0.25 mm |
Capillary | Squalane | 120. | 1104. | Rang, Kuningas, et al., 1976 | N2; Column length: 100. m; Column diameter: 0.25 mm |
Capillary | Squalane | 130. | 1104. | Rang, Kuningas, et al., 1976 | N2; Column length: 100. m; Column diameter: 0.25 mm |
Capillary | Apiezon L | 110. | 1110. | Rang, Kuningas, et al., 1976 | N2; Column length: 50. m; Column diameter: 0.25 mm |
Capillary | Apiezon L | 130. | 1110. | Rang, Kuningas, et al., 1976 | N2; Column length: 50. m; Column diameter: 0.25 mm |
Capillary | Apiezon L | 150. | 1109. | Rang, Kuningas, et al., 1976 | N2; Column length: 50. m; Column diameter: 0.25 mm |
Capillary | Apiezon L | 170. | 1109. | Rang, Kuningas, et al., 1976 | N2; Column length: 50. m; Column diameter: 0.25 mm |
Kovats' RI, polar column, isothermal
Column type | Active phase | Temperature (C) | I | Reference | Comment |
---|---|---|---|---|---|
Capillary | PEG 4000 | 100. | 1286. | Rang, Orav, et al., 1988 | |
Capillary | PEG 4000 | 110. | 1286. | Rang, Orav, et al., 1988 | |
Capillary | PEG 4000 | 120. | 1286. | Rang, Orav, et al., 1988 | |
Capillary | PEG 4000 | 140. | 1287. | Rang, Orav, et al., 1988 | |
Capillary | PEG 4000 | 150. | 1286. | Rang, Orav, et al., 1988 | |
Capillary | PEG 4000 | 160. | 1286. | Rang, Orav, et al., 1988 | |
Capillary | PEG-20M | 61. | 1261.1 | Orav, Kuningas, et al., 1985 | Column length: 100. m; Column diameter: 0.25 mm |
Capillary | PEG-20M | 61. | 1277.5 | Orav, Kuningas, et al., 1985 | Column length: 100. m; Column diameter: 0.25 mm |
Capillary | PEG-20M | 70. | 1263.6 | Orav, Kuningas, et al., 1985 | Column length: 100. m; Column diameter: 0.25 mm |
Capillary | PEG-20M | 70. | 1278.8 | Orav, Kuningas, et al., 1985 | Column length: 100. m; Column diameter: 0.25 mm |
Capillary | PEG-20M | 80. | 1266. | Orav, Kuningas, et al., 1985 | Column length: 100. m; Column diameter: 0.25 mm |
Capillary | PEG-20M | 80. | 1280.4 | Orav, Kuningas, et al., 1985 | Column length: 100. m; Column diameter: 0.25 mm |
References
Go To: Top, Phase change data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Farchan Laboratories, 1990
Farchan Laboratories,
Research Chemicals Catalog, Farchan Laboratories, Gainesville, FL, 1990, 91. [all data]
Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]
Truchet, 1931
Truchet, R.,
Ann. Chim. (Paris), 1931, 16, 309. [all data]
Truchet, 1930
Truchet, R.,
A Metrhod for the Preparation of Substituted Acetylenic Hydrocarbons,
C. R. Hebd. Seances Acad. Sci., 1930, 191, 854. [all data]
Rang and Martinson, 1978
Rang, S.; Martinson, E.,
Ionization potentials of unsaturated hydrocarbons. 3. n-Alkyunes C8-C12.,
Eesti. NSV Tead. Akad. Toim. Keem., 1978, 44. [all data]
Soják, Farkas, et al., 1991
Soják, L.; Farkas, P.; Ostrovský, I.; Janák, J.; Chrétien, J.R.,
Capillary gas chromatography of C5 - C13 branched alkynes on squalane and liquid crystal stationary phases,
J. Chromatogr., 1991, 557, 241-253, https://doi.org/10.1016/S0021-9673(01)87136-3
. [all data]
Kuningas, Rang, et al., 1990
Kuningas, K.; Rang, S.; Kailas, T.,
Relationship between the structure and retention of n-alkenes and n-alkynes on silicone phases,
J. Chromatogr., 1990, 520, 137-148, https://doi.org/10.1016/0021-9673(90)85094-C
. [all data]
Rang, Kuningas, et al., 1976
Rang, S.; Kuningas, K.; Orav, A.; Eisen, O.,
Capillary gas chromatography of n-alkynes. I. Retention indices,
J. Chromatogr., 1976, 119, 451-460, https://doi.org/10.1016/S0021-9673(00)86807-7
. [all data]
Rang, Orav, et al., 1988
Rang, S.A.; Orav, A.E.; Kuningas, K.R.; Meister, A.E.; Strense, T.V.; Eisen, O.G.,
Gas-Chromatographic Characteristics of unsaturated hydrocarbons, Academy of Sciences of Estonia SSR, Tallinn, Estonia SSR, 1988, 208. [all data]
Orav, Kuningas, et al., 1985
Orav, A.; Kuningas, K.; Rang, S.; Eisen, O.,
Capillary gas chromatography of n-tridecenes, n-tetradecenes and C10-C14 n-alkynes on polyethylene glycol 20m of different polarity,
Eesti NSV Tead. Akad. Toim. Keem., 1985, 34, 2, 105-113. [all data]
Notes
Go To: Top, Phase change data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, References
- Symbols used in this document:
Tboil Boiling point - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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