Single Crystal of 1-(2'-hidroxyphenyl)-3-hidroxy-3-(4-methoxyphenil)-propan-1-one: Synthesis, structure and vibrational properties

Detalhes bibliográficos
Autor(a) principal: Bitencourt , Heriberto Rodrigues
Data de Publicação: 2022
Outros Autores: Pinheiro, José Ciriaco, Souza Filho, Antônio Pedro da Silva, Moreira, Sanclayton Geraldo, Ayala, Alejandro Pedro, Remédios, Cláudio Márcio Rocha
Tipo de documento: Artigo
Idioma: por
Título da fonte: Research, Society and Development
Texto Completo: https://rsdjournal.org/index.php/rsd/article/view/31433
Resumo: Chalcones, flavonoids, isoflavonoids and other derived substances have been extensively studied in recent years presenting various pharmacological activities and in some cases presenting very important physical properties such as non-linear optical properties (ONL). Recently it was observed that the compound 1-(2'-hydroxyphenyl)-3-hydroxy-3-(4-methoxyphenyl)-propan-1-one is an intermediate precursor in the biosynthesis of (2E)-1-(2-hydroxyphenyl) -3-(4-methoxyphenyl)prop-2-en-1-one, which is a compound belonging to the class of chalcones. After this observation, said precursor compound was crystallized in the laboratory and its crystal structure was identified by X-ray diffraction. The title compound was synthesized and crystallized from methanol in the centrosymmetric space group P21/c. The geometric parameters and supramolecular arrangement of the crystal structure obtained from single crystal X-ray diffraction data were analyzed. Furthermore, the vibrational properties were characterized by Raman spectroscopy. The attributions of the vibrational modes and detailed information of the synthesis are presented.
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spelling Single Crystal of 1-(2'-hidroxyphenyl)-3-hidroxy-3-(4-methoxyphenil)-propan-1-one: Synthesis, structure and vibrational propertiesMonocristales de 1-(2'-hidroxifenil)-3-hidroxi-3-(4-metoxifenil)-propan-1-ona: Síntesis, estructura y propiedades vibratóriasMonocristais de 1-(2'-hidroxifenil)-3-hidroxi-3-(4-metoxifenil)-propan-1-ona: Síntese, estrutura e propriedades vibracionaisDerivados de chalconasSíntese de flavonóidesEstrutura de flavonóidesRaman em flavonóides.Derivados de chalconasSíntesis de flavonoidesEstructura de flavonoidesRaman en flavonoides.Chalcones derivativesFlavonoid synthesisFlavonoids structureRaman in flavonoids.Chalcones, flavonoids, isoflavonoids and other derived substances have been extensively studied in recent years presenting various pharmacological activities and in some cases presenting very important physical properties such as non-linear optical properties (ONL). Recently it was observed that the compound 1-(2'-hydroxyphenyl)-3-hydroxy-3-(4-methoxyphenyl)-propan-1-one is an intermediate precursor in the biosynthesis of (2E)-1-(2-hydroxyphenyl) -3-(4-methoxyphenyl)prop-2-en-1-one, which is a compound belonging to the class of chalcones. After this observation, said precursor compound was crystallized in the laboratory and its crystal structure was identified by X-ray diffraction. The title compound was synthesized and crystallized from methanol in the centrosymmetric space group P21/c. The geometric parameters and supramolecular arrangement of the crystal structure obtained from single crystal X-ray diffraction data were analyzed. Furthermore, the vibrational properties were characterized by Raman spectroscopy. The attributions of the vibrational modes and detailed information of the synthesis are presented.Las chalconas, flavonoides, isoflavonoides y otras sustancias derivadas han sido ampliamente estudiadas en los últimos años presentando diversas actividades farmacológicas y en algunos casos presentando propiedades físicas muy importantes como las propiedades ópticas no lineales (ONL). Recientemente se observó que el compuesto 1-(2'-hidroxifenil)-3-hidroxi-3-(4-metoxifenil)-propan-1-ona es un precursor intermedio en la biosíntesis de (2E)-1-(2- hidroxifenil) -3-(4-metoxifenil)prop-2-en-1-ona, que es un compuesto que pertenece a la clase de las chalconas. Después de esta observación, dicho compuesto precursor se cristalizó en el laboratorio y se identificó su estructura cristalina por difracción de rayos X. El compuesto del título se sintetizó y cristalizó a partir de metanol en el grupo espacial centrosimétrico P21/c. Se analizaron los parámetros geométricos y la disposición supramolecular de la estructura cristalina obtenida a partir de datos de difracción de rayos X de monocristal. Además, las propiedades vibratorias se caracterizaron por espectroscopía Raman. Se presentan las atribuciones de los modos vibracionales e información detallada de la síntesis.Chalconas, flavonóides, isoflavonóides e outras substâncias derivadas têm sido muito estudadas nos anos recentes apresentando várias atividades farmacológicas e em alguns casos apresentando propriedades físicas muito importantes como as propriedades óticas não lineares (ONL). Recentemente observou-se que o composto 1-(2'-hidroxifenil)-3-hidroxi-3-(4-metoxifenil)-propan-1-ona é um precursor intermediário na biossíntese de (2E)-1-(2-hidroxifenil) -3-(4-metoxifenil)prop-2-en-1-ona, que é um composto pertencente a classe das chalconas. Após esta observação o referido composto precursor foi cristalizado em laboratório e sua estrutura cristalina foi identificada por difração de raios X. O composto do título foi sintetizado e cristalizado a partir de metanol no grupo espacial centrossimétrico P21/c. Foram analisados os parâmetros geométricos e arranjo supramolecular da estrutura cristalina obtida a partir de dados de difração de raios X de monocristal. Além disso, as propriedades vibracionais foram caracterizadas por espectroscopia Raman. São apresentadas as atribuições dos modos vibracionais e informações detalhadas da síntese.Research, Society and Development2022-07-04info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionapplication/pdfhttps://rsdjournal.org/index.php/rsd/article/view/3143310.33448/rsd-v11i9.31433Research, Society and Development; Vol. 11 No. 9; e10311931433Research, Society and Development; Vol. 11 Núm. 9; e10311931433Research, Society and Development; v. 11 n. 9; e103119314332525-3409reponame:Research, Society and Developmentinstname:Universidade Federal de Itajubá (UNIFEI)instacron:UNIFEIporhttps://rsdjournal.org/index.php/rsd/article/view/31433/26962Copyright (c) 2022 Heriberto Rodrigues Bitencourt ; José Ciriaco Pinheiro; Antônio Pedro da Silva Souza Filho; Sanclayton Geraldo Moreira; Alejandro Pedro Ayala; Cláudio Márcio Rocha Remédioshttps://creativecommons.org/licenses/by/4.0info:eu-repo/semantics/openAccessBitencourt , Heriberto Rodrigues Pinheiro, José Ciriaco Souza Filho, Antônio Pedro da Silva Moreira, Sanclayton Geraldo Ayala, Alejandro PedroRemédios, Cláudio Márcio Rocha2022-07-21T12:36:16Zoai:ojs.pkp.sfu.ca:article/31433Revistahttps://rsdjournal.org/index.php/rsd/indexPUBhttps://rsdjournal.org/index.php/rsd/oairsd.articles@gmail.com2525-34092525-3409opendoar:2024-01-17T09:47:46.936175Research, Society and Development - Universidade Federal de Itajubá (UNIFEI)false
dc.title.none.fl_str_mv Single Crystal of 1-(2'-hidroxyphenyl)-3-hidroxy-3-(4-methoxyphenil)-propan-1-one: Synthesis, structure and vibrational properties
Monocristales de 1-(2'-hidroxifenil)-3-hidroxi-3-(4-metoxifenil)-propan-1-ona: Síntesis, estructura y propiedades vibratórias
Monocristais de 1-(2'-hidroxifenil)-3-hidroxi-3-(4-metoxifenil)-propan-1-ona: Síntese, estrutura e propriedades vibracionais
title Single Crystal of 1-(2'-hidroxyphenyl)-3-hidroxy-3-(4-methoxyphenil)-propan-1-one: Synthesis, structure and vibrational properties
spellingShingle Single Crystal of 1-(2'-hidroxyphenyl)-3-hidroxy-3-(4-methoxyphenil)-propan-1-one: Synthesis, structure and vibrational properties
Bitencourt , Heriberto Rodrigues
Derivados de chalconas
Síntese de flavonóides
Estrutura de flavonóides
Raman em flavonóides.
Derivados de chalconas
Síntesis de flavonoides
Estructura de flavonoides
Raman en flavonoides.
Chalcones derivatives
Flavonoid synthesis
Flavonoids structure
Raman in flavonoids.
title_short Single Crystal of 1-(2'-hidroxyphenyl)-3-hidroxy-3-(4-methoxyphenil)-propan-1-one: Synthesis, structure and vibrational properties
title_full Single Crystal of 1-(2'-hidroxyphenyl)-3-hidroxy-3-(4-methoxyphenil)-propan-1-one: Synthesis, structure and vibrational properties
title_fullStr Single Crystal of 1-(2'-hidroxyphenyl)-3-hidroxy-3-(4-methoxyphenil)-propan-1-one: Synthesis, structure and vibrational properties
title_full_unstemmed Single Crystal of 1-(2'-hidroxyphenyl)-3-hidroxy-3-(4-methoxyphenil)-propan-1-one: Synthesis, structure and vibrational properties
title_sort Single Crystal of 1-(2'-hidroxyphenyl)-3-hidroxy-3-(4-methoxyphenil)-propan-1-one: Synthesis, structure and vibrational properties
author Bitencourt , Heriberto Rodrigues
author_facet Bitencourt , Heriberto Rodrigues
Pinheiro, José Ciriaco
Souza Filho, Antônio Pedro da Silva
Moreira, Sanclayton Geraldo
Ayala, Alejandro Pedro
Remédios, Cláudio Márcio Rocha
author_role author
author2 Pinheiro, José Ciriaco
Souza Filho, Antônio Pedro da Silva
Moreira, Sanclayton Geraldo
Ayala, Alejandro Pedro
Remédios, Cláudio Márcio Rocha
author2_role author
author
author
author
author
dc.contributor.author.fl_str_mv Bitencourt , Heriberto Rodrigues
Pinheiro, José Ciriaco
Souza Filho, Antônio Pedro da Silva
Moreira, Sanclayton Geraldo
Ayala, Alejandro Pedro
Remédios, Cláudio Márcio Rocha
dc.subject.por.fl_str_mv Derivados de chalconas
Síntese de flavonóides
Estrutura de flavonóides
Raman em flavonóides.
Derivados de chalconas
Síntesis de flavonoides
Estructura de flavonoides
Raman en flavonoides.
Chalcones derivatives
Flavonoid synthesis
Flavonoids structure
Raman in flavonoids.
topic Derivados de chalconas
Síntese de flavonóides
Estrutura de flavonóides
Raman em flavonóides.
Derivados de chalconas
Síntesis de flavonoides
Estructura de flavonoides
Raman en flavonoides.
Chalcones derivatives
Flavonoid synthesis
Flavonoids structure
Raman in flavonoids.
description Chalcones, flavonoids, isoflavonoids and other derived substances have been extensively studied in recent years presenting various pharmacological activities and in some cases presenting very important physical properties such as non-linear optical properties (ONL). Recently it was observed that the compound 1-(2'-hydroxyphenyl)-3-hydroxy-3-(4-methoxyphenyl)-propan-1-one is an intermediate precursor in the biosynthesis of (2E)-1-(2-hydroxyphenyl) -3-(4-methoxyphenyl)prop-2-en-1-one, which is a compound belonging to the class of chalcones. After this observation, said precursor compound was crystallized in the laboratory and its crystal structure was identified by X-ray diffraction. The title compound was synthesized and crystallized from methanol in the centrosymmetric space group P21/c. The geometric parameters and supramolecular arrangement of the crystal structure obtained from single crystal X-ray diffraction data were analyzed. Furthermore, the vibrational properties were characterized by Raman spectroscopy. The attributions of the vibrational modes and detailed information of the synthesis are presented.
publishDate 2022
dc.date.none.fl_str_mv 2022-07-04
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
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format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv https://rsdjournal.org/index.php/rsd/article/view/31433
10.33448/rsd-v11i9.31433
url https://rsdjournal.org/index.php/rsd/article/view/31433
identifier_str_mv 10.33448/rsd-v11i9.31433
dc.language.iso.fl_str_mv por
language por
dc.relation.none.fl_str_mv https://rsdjournal.org/index.php/rsd/article/view/31433/26962
dc.rights.driver.fl_str_mv https://creativecommons.org/licenses/by/4.0
info:eu-repo/semantics/openAccess
rights_invalid_str_mv https://creativecommons.org/licenses/by/4.0
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv application/pdf
dc.publisher.none.fl_str_mv Research, Society and Development
publisher.none.fl_str_mv Research, Society and Development
dc.source.none.fl_str_mv Research, Society and Development; Vol. 11 No. 9; e10311931433
Research, Society and Development; Vol. 11 Núm. 9; e10311931433
Research, Society and Development; v. 11 n. 9; e10311931433
2525-3409
reponame:Research, Society and Development
instname:Universidade Federal de Itajubá (UNIFEI)
instacron:UNIFEI
instname_str Universidade Federal de Itajubá (UNIFEI)
instacron_str UNIFEI
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reponame_str Research, Society and Development
collection Research, Society and Development
repository.name.fl_str_mv Research, Society and Development - Universidade Federal de Itajubá (UNIFEI)
repository.mail.fl_str_mv rsd.articles@gmail.com
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