Low temperature polymorphism in 3-amino-1-propanol

Detalhes bibliográficos
Autor(a) principal: Cacela, C.
Data de Publicação: 2003
Outros Autores: Baudot, A., Duarte, M. L., Matos-Beja, A. M., Silva, M. Ramos, Paixão, J. A., Fausto, R.
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos)
Texto Completo: http://hdl.handle.net/10316/5164
https://doi.org/10.1016/S0022-2860(03)00049-8
Resumo: 3-Amino-1-propanol (3AP) was investigated by differential scanning calorimetry, and low temperature powder X-ray diffraction and Raman spectroscopy. Within the range of temperatures studied (-150-25 °C), 3AP was found to be able to crystallize in two monotropic polymorphs. Fast cooling rates produce an amorphous state that, on heating, crystallizes into the metastable polymorph. At higher temperatures, this metastable crystalline phase converts into the stable crystal. Using intermediate cooling rates, 3AP crystallizes as the metastable polymorph, the solid[right triple arrow]solid transition leading to conversion of this form into the stable polymorph occurring during the subsequent heating. Slower cooling rates enable formation of the stable crystal on cooling. The two crystalline polymorphs were structurally characterized by powder X-ray diffraction and Raman spectroscopy. It was concluded that different conformations are assumed by the individual molecules of 3AP in the two crystalline varieties, with the molecules assuming the all-trans configuration in the metastable crystalline state and having the heavy atom backbone trans but the NH2 and OH groups gauche in the stable crystal.
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spelling Low temperature polymorphism in 3-amino-1-propanol3-Amino-1-propanolX-ray diffraction and Raman spectroscopyDifferential Scanning Calorimetry3-Amino-1-propanol (3AP) was investigated by differential scanning calorimetry, and low temperature powder X-ray diffraction and Raman spectroscopy. Within the range of temperatures studied (-150-25 °C), 3AP was found to be able to crystallize in two monotropic polymorphs. Fast cooling rates produce an amorphous state that, on heating, crystallizes into the metastable polymorph. At higher temperatures, this metastable crystalline phase converts into the stable crystal. Using intermediate cooling rates, 3AP crystallizes as the metastable polymorph, the solid[right triple arrow]solid transition leading to conversion of this form into the stable polymorph occurring during the subsequent heating. Slower cooling rates enable formation of the stable crystal on cooling. The two crystalline polymorphs were structurally characterized by powder X-ray diffraction and Raman spectroscopy. It was concluded that different conformations are assumed by the individual molecules of 3AP in the two crystalline varieties, with the molecules assuming the all-trans configuration in the metastable crystalline state and having the heavy atom backbone trans but the NH2 and OH groups gauche in the stable crystal.http://www.sciencedirect.com/science/article/B6TGS-481FSJV-2/1/6d44932042d3990f18c7e3cb071cddf82003info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articleaplication/PDFhttp://hdl.handle.net/10316/5164http://hdl.handle.net/10316/5164https://doi.org/10.1016/S0022-2860(03)00049-8engJournal of Molecular Structure. 649:1-2 (2003) 143-153Cacela, C.Baudot, A.Duarte, M. L.Matos-Beja, A. M.Silva, M. RamosPaixão, J. A.Fausto, R.info:eu-repo/semantics/openAccessreponame:Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos)instname:Agência para a Sociedade do Conhecimento (UMIC) - FCT - Sociedade da Informaçãoinstacron:RCAAP2021-10-15T07:47:17Zoai:estudogeral.uc.pt:10316/5164Portal AgregadorONGhttps://www.rcaap.pt/oai/openaireopendoar:71602024-03-19T21:01:29.811260Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos) - Agência para a Sociedade do Conhecimento (UMIC) - FCT - Sociedade da Informaçãofalse
dc.title.none.fl_str_mv Low temperature polymorphism in 3-amino-1-propanol
title Low temperature polymorphism in 3-amino-1-propanol
spellingShingle Low temperature polymorphism in 3-amino-1-propanol
Cacela, C.
3-Amino-1-propanol
X-ray diffraction and Raman spectroscopy
Differential Scanning Calorimetry
title_short Low temperature polymorphism in 3-amino-1-propanol
title_full Low temperature polymorphism in 3-amino-1-propanol
title_fullStr Low temperature polymorphism in 3-amino-1-propanol
title_full_unstemmed Low temperature polymorphism in 3-amino-1-propanol
title_sort Low temperature polymorphism in 3-amino-1-propanol
author Cacela, C.
author_facet Cacela, C.
Baudot, A.
Duarte, M. L.
Matos-Beja, A. M.
Silva, M. Ramos
Paixão, J. A.
Fausto, R.
author_role author
author2 Baudot, A.
Duarte, M. L.
Matos-Beja, A. M.
Silva, M. Ramos
Paixão, J. A.
Fausto, R.
author2_role author
author
author
author
author
author
dc.contributor.author.fl_str_mv Cacela, C.
Baudot, A.
Duarte, M. L.
Matos-Beja, A. M.
Silva, M. Ramos
Paixão, J. A.
Fausto, R.
dc.subject.por.fl_str_mv 3-Amino-1-propanol
X-ray diffraction and Raman spectroscopy
Differential Scanning Calorimetry
topic 3-Amino-1-propanol
X-ray diffraction and Raman spectroscopy
Differential Scanning Calorimetry
description 3-Amino-1-propanol (3AP) was investigated by differential scanning calorimetry, and low temperature powder X-ray diffraction and Raman spectroscopy. Within the range of temperatures studied (-150-25 °C), 3AP was found to be able to crystallize in two monotropic polymorphs. Fast cooling rates produce an amorphous state that, on heating, crystallizes into the metastable polymorph. At higher temperatures, this metastable crystalline phase converts into the stable crystal. Using intermediate cooling rates, 3AP crystallizes as the metastable polymorph, the solid[right triple arrow]solid transition leading to conversion of this form into the stable polymorph occurring during the subsequent heating. Slower cooling rates enable formation of the stable crystal on cooling. The two crystalline polymorphs were structurally characterized by powder X-ray diffraction and Raman spectroscopy. It was concluded that different conformations are assumed by the individual molecules of 3AP in the two crystalline varieties, with the molecules assuming the all-trans configuration in the metastable crystalline state and having the heavy atom backbone trans but the NH2 and OH groups gauche in the stable crystal.
publishDate 2003
dc.date.none.fl_str_mv 2003
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dc.identifier.uri.fl_str_mv http://hdl.handle.net/10316/5164
http://hdl.handle.net/10316/5164
https://doi.org/10.1016/S0022-2860(03)00049-8
url http://hdl.handle.net/10316/5164
https://doi.org/10.1016/S0022-2860(03)00049-8
dc.language.iso.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv Journal of Molecular Structure. 649:1-2 (2003) 143-153
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