Polyfunctional Energetic Nitrates Derived from Tris(hydroxymethyl)aminomethane (Tris)
A variety of new energetic compounds were synthesized with the tris(hydroxymethyl)aminomethane (Tris) moiety as a building block. The new nitrates were fully characterized, with use of multinuclear NMR spectroscopy, vibrational analysis, mass spectrometry, differential scanning calorimetry, and elem...
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| Veröffentlicht in: | European journal of organic chemistry 2017-07, Vol.2017 (25), p.3666-3673 |
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| container_title | European journal of organic chemistry |
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| creator | Klapötke, Thomas M. Krumm, Burkhard Reith, Thomas |
| description | A variety of new energetic compounds were synthesized with the tris(hydroxymethyl)aminomethane (Tris) moiety as a building block. The new nitrates were fully characterized, with use of multinuclear NMR spectroscopy, vibrational analysis, mass spectrometry, differential scanning calorimetry, and elemental analysis. The structure of each compound was confirmed by single‐crystal X‐ray diffraction. The energies of formation were calculated with the Gaussian program package, and the detonation parameters were predicted by using the EXPLO5 computer code. Because of the positive oxygen balance (ΩCO) of the presented compounds, their performance data as oxidizers were compared to the common oxidizer ammonium perchlorate.
Synthesis, full characterization, physical properties, and crystal structures of energetic nitrates based on easily available Tris were determined and investigated. The new energetic materials were compared to the well‐established nitrate pentaerythritol tetranitrate (PETN) and to the oxidizer ammonium perchlorate (AP). |
| doi_str_mv | 10.1002/ejoc.201700434 |
| format | Article |
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Synthesis, full characterization, physical properties, and crystal structures of energetic nitrates based on easily available Tris were determined and investigated. The new energetic materials were compared to the well‐established nitrate pentaerythritol tetranitrate (PETN) and to the oxidizer ammonium perchlorate (AP).</description><identifier>ISSN: 1434-193X</identifier><identifier>EISSN: 1099-0690</identifier><identifier>DOI: 10.1002/ejoc.201700434</identifier><language>eng</language><publisher>Weinheim: Wiley Subscription Services, Inc</publisher><subject>Crystal structure ; Detonation ; Differential scanning calorimetry ; Diffraction ; Energetic materials ; Explosives ; Heat measurement ; Mass spectrometry ; Nitrates ; Nitrogen ; NMR spectroscopy ; Organic nitrates ; Oxidizer ; Oxidizing agents ; Oxygen ; Single crystals ; Software ; Spectroscopic analysis ; X-ray diffraction</subject><ispartof>European journal of organic chemistry, 2017-07, Vol.2017 (25), p.3666-3673</ispartof><rights>2017 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim</rights><rights>2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim</rights><lds50>peer_reviewed</lds50><oa>free_for_read</oa><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c3574-d24c035ae2f5e9fef89d300762460a16a1b541fd2a1dbcb269c15de627a7a8973</citedby><cites>FETCH-LOGICAL-c3574-d24c035ae2f5e9fef89d300762460a16a1b541fd2a1dbcb269c15de627a7a8973</cites><orcidid>0000-0002-2100-4540 ; 0000-0003-3276-1157</orcidid></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktopdf>$$Uhttps://onlinelibrary.wiley.com/doi/pdf/10.1002%2Fejoc.201700434$$EPDF$$P50$$Gwiley$$H</linktopdf><linktohtml>$$Uhttps://onlinelibrary.wiley.com/doi/full/10.1002%2Fejoc.201700434$$EHTML$$P50$$Gwiley$$H</linktohtml><link.rule.ids>314,776,780,1411,27901,27902,45550,45551</link.rule.ids></links><search><creatorcontrib>Klapötke, Thomas M.</creatorcontrib><creatorcontrib>Krumm, Burkhard</creatorcontrib><creatorcontrib>Reith, Thomas</creatorcontrib><title>Polyfunctional Energetic Nitrates Derived from Tris(hydroxymethyl)aminomethane (Tris)</title><title>European journal of organic chemistry</title><description>A variety of new energetic compounds were synthesized with the tris(hydroxymethyl)aminomethane (Tris) moiety as a building block. The new nitrates were fully characterized, with use of multinuclear NMR spectroscopy, vibrational analysis, mass spectrometry, differential scanning calorimetry, and elemental analysis. The structure of each compound was confirmed by single‐crystal X‐ray diffraction. The energies of formation were calculated with the Gaussian program package, and the detonation parameters were predicted by using the EXPLO5 computer code. Because of the positive oxygen balance (ΩCO) of the presented compounds, their performance data as oxidizers were compared to the common oxidizer ammonium perchlorate.
Synthesis, full characterization, physical properties, and crystal structures of energetic nitrates based on easily available Tris were determined and investigated. The new energetic materials were compared to the well‐established nitrate pentaerythritol tetranitrate (PETN) and to the oxidizer ammonium perchlorate (AP).</description><subject>Crystal structure</subject><subject>Detonation</subject><subject>Differential scanning calorimetry</subject><subject>Diffraction</subject><subject>Energetic materials</subject><subject>Explosives</subject><subject>Heat measurement</subject><subject>Mass spectrometry</subject><subject>Nitrates</subject><subject>Nitrogen</subject><subject>NMR spectroscopy</subject><subject>Organic nitrates</subject><subject>Oxidizer</subject><subject>Oxidizing agents</subject><subject>Oxygen</subject><subject>Single crystals</subject><subject>Software</subject><subject>Spectroscopic analysis</subject><subject>X-ray diffraction</subject><issn>1434-193X</issn><issn>1099-0690</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2017</creationdate><recordtype>article</recordtype><recordid>eNqFkD1PwzAQhi0EEqWwMkdiaYeUs-M49YhK-VJFGVqJLXKdM3WVxsVOgfx7EhXByHSvTs970j2EXFIYUQB2jRunRwxoBsATfkR6FKSMQUg4bnO7iqlMXk_JWQgbAJBC0B5ZvriyMftK19ZVqoymFfo3rK2Onm3tVY0hukVvP7CIjHfbaOFtGKybwruvZov1uimHamsr12VVYTTogOE5OTGqDHjxM_tkeTddTB7i2fz-cXIzi3WSZjwuGNeQpAqZSVEaNGNZJACZYFyAokLRVcqpKZiixUqvmJCapgUKlqlMjWWW9MnV4e7Ou_c9hjrfuL1v_wg5lVRyNuatiz4ZHSjtXQgeTb7zdqt8k1PIO3V5py7_VdcW5KHwaUts_qHz6dN88tf9BjrVc50</recordid><startdate>20170707</startdate><enddate>20170707</enddate><creator>Klapötke, Thomas M.</creator><creator>Krumm, Burkhard</creator><creator>Reith, Thomas</creator><general>Wiley Subscription Services, Inc</general><scope>AAYXX</scope><scope>CITATION</scope><orcidid>https://orcid.org/0000-0002-2100-4540</orcidid><orcidid>https://orcid.org/0000-0003-3276-1157</orcidid></search><sort><creationdate>20170707</creationdate><title>Polyfunctional Energetic Nitrates Derived from Tris(hydroxymethyl)aminomethane (Tris)</title><author>Klapötke, Thomas M. ; Krumm, Burkhard ; Reith, Thomas</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c3574-d24c035ae2f5e9fef89d300762460a16a1b541fd2a1dbcb269c15de627a7a8973</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2017</creationdate><topic>Crystal structure</topic><topic>Detonation</topic><topic>Differential scanning calorimetry</topic><topic>Diffraction</topic><topic>Energetic materials</topic><topic>Explosives</topic><topic>Heat measurement</topic><topic>Mass spectrometry</topic><topic>Nitrates</topic><topic>Nitrogen</topic><topic>NMR spectroscopy</topic><topic>Organic nitrates</topic><topic>Oxidizer</topic><topic>Oxidizing agents</topic><topic>Oxygen</topic><topic>Single crystals</topic><topic>Software</topic><topic>Spectroscopic analysis</topic><topic>X-ray diffraction</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Klapötke, Thomas M.</creatorcontrib><creatorcontrib>Krumm, Burkhard</creatorcontrib><creatorcontrib>Reith, Thomas</creatorcontrib><collection>CrossRef</collection><jtitle>European journal of organic chemistry</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Klapötke, Thomas M.</au><au>Krumm, Burkhard</au><au>Reith, Thomas</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Polyfunctional Energetic Nitrates Derived from Tris(hydroxymethyl)aminomethane (Tris)</atitle><jtitle>European journal of organic chemistry</jtitle><date>2017-07-07</date><risdate>2017</risdate><volume>2017</volume><issue>25</issue><spage>3666</spage><epage>3673</epage><pages>3666-3673</pages><issn>1434-193X</issn><eissn>1099-0690</eissn><abstract>A variety of new energetic compounds were synthesized with the tris(hydroxymethyl)aminomethane (Tris) moiety as a building block. The new nitrates were fully characterized, with use of multinuclear NMR spectroscopy, vibrational analysis, mass spectrometry, differential scanning calorimetry, and elemental analysis. The structure of each compound was confirmed by single‐crystal X‐ray diffraction. The energies of formation were calculated with the Gaussian program package, and the detonation parameters were predicted by using the EXPLO5 computer code. Because of the positive oxygen balance (ΩCO) of the presented compounds, their performance data as oxidizers were compared to the common oxidizer ammonium perchlorate.
Synthesis, full characterization, physical properties, and crystal structures of energetic nitrates based on easily available Tris were determined and investigated. The new energetic materials were compared to the well‐established nitrate pentaerythritol tetranitrate (PETN) and to the oxidizer ammonium perchlorate (AP).</abstract><cop>Weinheim</cop><pub>Wiley Subscription Services, Inc</pub><doi>10.1002/ejoc.201700434</doi><tpages>8</tpages><orcidid>https://orcid.org/0000-0002-2100-4540</orcidid><orcidid>https://orcid.org/0000-0003-3276-1157</orcidid><oa>free_for_read</oa></addata></record> |
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| language | eng |
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| source | Wiley Online Library Journals Frontfile Complete |
| subjects | Crystal structure Detonation Differential scanning calorimetry Diffraction Energetic materials Explosives Heat measurement Mass spectrometry Nitrates Nitrogen NMR spectroscopy Organic nitrates Oxidizer Oxidizing agents Oxygen Single crystals Software Spectroscopic analysis X-ray diffraction |
| title | Polyfunctional Energetic Nitrates Derived from Tris(hydroxymethyl)aminomethane (Tris) |
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