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2,2,3,3-四氟丙基三氟甲烷磺酸酯 | 6401-02-1

中文名称
2,2,3,3-四氟丙基三氟甲烷磺酸酯
中文别名
——
英文名称
2,2,3,3-tetrafluoropropyl trifluoromethanesulfonate
英文别名
——
2,2,3,3-四氟丙基三氟甲烷磺酸酯化学式
CAS
6401-02-1
化学式
C4H3F7O3S
mdl
MFCD02093338
分子量
264.121
InChiKey
OSWSZHMBICDPQH-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

物化性质

  • 熔点:
    114-118 °C
  • 沸点:
    122-125/737mm
  • 密度:
    1.644±0.06 g/cm3(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    2.4
  • 重原子数:
    15
  • 可旋转键数:
    4
  • 环数:
    0.0
  • sp3杂化的碳原子比例:
    1.0
  • 拓扑面积:
    51.8
  • 氢给体数:
    0
  • 氢受体数:
    10

安全信息

  • 危险等级:
    TOXIC, CORROSIVE
  • 危险品标志:
    Xi,T,C
  • 海关编码:
    2905590090

SDS

SDS:cadda9ada14ec02fc12d3cd8d1fd2b3a
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反应信息

  • 作为反应物:
    参考文献:
    名称:
    METHODS OF MAKING FLUORINATED ETHERS, FLUORINATED ETHERS, AND USES THEREOF
    摘要:
    一种制备氟化醚的方法包括在极性无水溶剂中结合以下物质:由公式X—Rf1CH2OH表示的氟化醇,以及由公式Rf2CH2OS(═O)2Rf3表示的氟化磺酸酯酯和碱;并获得由公式Y—Rf1CH2OCH2Rf2—Y表示的氟化醚。其中,Rf1选择自具有1至10个碳原子的全氟化C1-C10烷基基团和部分氟化C1-C10烷基基团,以及具有连续杂原子的衍生物。X代表H、F或HOCH2—基团。Rf2选择自全氟化C1-C10烷基基团和部分氟化C1-C10烷基基团,以及具有连续杂原子的衍生物。Rf3是C1-C4烷基基团。Y代表H、F或Rf2CH2OCH2—基团。还公开了一种用于制备对称氟化醚的变种方法。本公开还提供了根据该方法可制备的氟化醚。还公开了氟化醚在各种应用中的使用。
    公开号:
    US20100108934A1
  • 作为产物:
    参考文献:
    名称:
    [EN] NITRILE COMPOUND AND ITS USE IN PEST CONTROL
    [FR] COMPOSE NITRILE ET SON UTILISATION POUR LE CONTROLE DES INSECTES ET ANIMAUX NUISIBLES
    摘要:
    本发明提供了一种由式(I)表示的腈化合物:其中R代表C1-C4氟烷基,Q代表卤素,C1-C11烷基可选择地取代卤素,C2-C6烯基基团可选择地取代卤素,C2-C6炔基可选择地取代卤素,C3-C7环烷基可选择地取代卤素或(C3-C7环烷基可选择地取代卤素)C1-C4烷基,对害虫具有出色的控制效果。
    公开号:
    WO2005063694A1
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文献信息

  • [EN] INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION<br/>[FR] INHIBITEURS DE LA RÉPLICATION DU VIRUS DE L'IMMUNODÉFICIENCE HUMAINE
    申请人:VIIV HEALTHCARE UK NO 5 LTD
    公开号:WO2021064677A1
    公开(公告)日:2021-04-08
    Compounds of Formula I, including pharmaceutically acceptable salts thereof, and compositions and methods for treating human immunodeficiency virus (HIV) infection are set forth: Formula I.
    公式I的化合物,包括其药用可接受的盐,以及用于治疗人类免疫缺陷病毒(HIV)感染的组合物和方法如下:公式I。
  • [EN] 1,3,4-OXADIAZOLE HOMOPHTHALIMIDE DERIVATIVE COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND THE PHARMACEUTICAL COMPOSITION COMPRISING THE SAME<br/>[FR] COMPOSÉS DÉRIVÉS DE 1,3,4-OXADIAZOLE HOMOPHTALIMIDE UTILISÉS COMME INHIBITEUR DE L'HISTONE DÉSACÉTYLASE 6, ET COMPOSITION PHARMACEUTIQUE LES COMPRENANT
    申请人:CHONG KUN DANG PHARMACEUTICAL CORP
    公开号:WO2020240493A1
    公开(公告)日:2020-12-03
    The present invention relates to novel compounds having a histone deacetylase 6 (HDAC6) inhibitory activity, stereoisomers thereof or pharmaceutically acceptable salts thereof, a medicinal use thereof, and a method for preparing the same. The novel compounds according to the present invention, stereoisomers thereof or pharmaceutically acceptable salts thereof have the histone deacetylase 6 (HDAC6) inhibitory activity, and are effective in preventing or treating HDAC6-related diseases, comprising infectious diseases; neoplasm; endocrinopathy; nutritional and metabolic diseases; mental and behavioral disorders; neurological diseases; eye and ocular adnexal diseases; circulatory diseases; respiratory diseases; digestive diseases; skin and subcutaneous tissue diseases; musculoskeletal system and connective tissue diseases; and teratosis or deformities, or chromosomal aberration.
    本发明涉及具有组蛋白去乙酰化酶6(HDAC6)抑制活性的新化合物,其立体异构体或其药学上可接受的盐,其药用用途以及其制备方法。根据本发明的新化合物,其立体异构体或其药学上可接受的盐具有组蛋白去乙酰化酶6(HDAC6)抑制活性,并且在预防或治疗与HDAC6相关的疾病方面具有有效性,包括传染病;肿瘤;内分泌病;营养和代谢疾病;精神和行为障碍;神经系统疾病;眼部和眼附器疾病;循环系统疾病;呼吸系统疾病;消化系统疾病;皮肤和皮下组织疾病;肌肉骨骼系统和结缔组织疾病;以及畸形或变形,或染色体异常。
  • Piperidinyl-and piperazinyl-sulfonylmethyl hydroxamic acids and their use as protease inhibitors
    申请人:Barta E. Thomas
    公开号:US20050009838A1
    公开(公告)日:2005-01-13
    This invention is directed generally to proteinase (also known as “protease”) inhibitors, and, more particularly, to piperidinyl- and piperazinyl-sulfonylmethyl hydroxamic acids that, inter alia, inhibit matrix metalloproteinase (also known as “matrix metalloprotease” or “MMP”) activity and/or aggrecanase activity. Such hydroxamic acids generally correspond in structure to the following formula: (wherein A 1 , A 2 , Y, E 1 , E 2 , E 3 , and R x are as defined in this specification), and further include salts of such compounds. This invention also is directed to compositions of such hydroxamic acids, intermediates for the syntheses of such hydroxamic acids, methods for making such hydroxamic acids, and methods for treating conditions (particularly pathological conditions) associated with MMP activity and/or aggrecanase activity.
    这项发明通常涉及蛋白酶抑制剂(也称为“蛋白酶”),更具体地涉及对哌啶基和哌嗪基磺酰甲基羟肟酸的抑制作用,其中包括抑制基质金属蛋白酶(也称为“基质金属蛋白酶”或“MMP”)活性和/或聚集素酶活性。这些羟肟酸通常在结构上对应于以下公式: (其中A 1 ,A 2 ,Y,E 1 ,E 2 ,E 3 和R x 如本说明书中所定义),并进一步包括这些化合物的盐。这项发明还涉及这些羟肟酸的组合物,合成这些羟肟酸的中间体,制备这些羟肟酸的方法,以及治疗与MMP活性和/或聚集素酶活性相关的病症(特别是病理性病症)的方法。
  • Piperidinyl- and piperazinyl-sulfonylmethyl hydroxamic acids and their use as protease inhibitors
    申请人:McDonald J. Joseph
    公开号:US20050209278A1
    公开(公告)日:2005-09-22
    This invention is directed generally to proteinase (also known as “protease”) inhibitors, and, more particularly, to piperidinyl- and piperazinyl-sulfonylmethyl hydroxamic acids that, inter alia, inhibit matrix metalloproteinase (also known as “matrix metalloprotease” or “MMP”) activity and/or aggrecanase activity. Such hydroxamic acids generally correspond in structure to the following formula: (wherein A 1 , A 2 , Y, E 1 , E 2 , E 3 , and R x are as defined in this specification), and further include salts of such compounds. This invention also is directed to compositions of such hydroxamic acids, intermediates for the syntheses of such hydroxamic acids, methods for making such hydroxamic acids, and methods for treating conditions (particularly pathological conditions) associated with MMP activity and/or aggrecanase activity.
    这项发明通常涉及蛋白酶抑制剂(也称为“蛋白酶”),更具体地涉及哌啶基和哌嗪基磺酰甲基羟肟酸,该类化合物在结构上抑制基质金属蛋白酶(也称为“基质金属蛋白酶”或“MMP”)活性和/或聚集素酶活性。这类羟肟酸通常对应以下结构式: (其中A1、A2、Y、E1、E2、E3和Rx如本说明书中所定义),还包括这类化合物的盐。这项发明还涉及这类羟肟酸的组合物、合成这类羟肟酸的中间体、制备这类羟肟酸的方法,以及治疗与MMP活性和/或聚集素酶活性相关的疾病(特别是病理性疾病)的方法。
  • [EN] CYCLOPROPYL FUSED THIAZIN-2-AMINE COMPOUNDS AS BETA-SECRETASE INHIBITORS AND METHODS OF USE<br/>[FR] COMPOSÉS THIAZIN-2-AMINE FUSIONNÉE À UN GROUPEMENT CYCLOPROPYLE UTILISÉS EN TANT QU'INHIBITEURS DE LA BÊTA-SECRÉTASE ET LEURS PROCÉDÉS D'UTILISATION
    申请人:AMGEN INC
    公开号:WO2016022724A1
    公开(公告)日:2016-02-11
    The present invention provides a new class of compounds useful for the modulation of beta-secretase enzyme (BACE) activity. The compounds have a general Formula (I): wherein variables A4, A5, A6, A8, and each of Ra, Rb, R1, R2, R3 and R7 of Formula (I), independently, are defined herein. The invention also provides pharmaceutical compositions comprising the compounds, and uses of the compounds and compositions for treatment of disorders and/or conditions related to A-beta plaque formation and 15 deposition, resulting from the biological activity of BACE. Such BACE mediated disorders include, for example, Alzheimers Disease, cognitive deficits, cognitive impairments, schizophrenia and other central nervous system conditions. The invention further provides compounds of Formulas (II) and (III), and sub-formula embodiments thereof, intermediates and methods for preparing compounds of the invention.
    本发明提供了一类新的化合物,用于调节β-分泌酶(BACE)活性。这些化合物具有一般式(I):其中一般式(I)中的变量A4、A5、A6、A8,以及Ra、Rb、R1、R2、R3和R7各自独立地在此定义。该发明还提供了包括这些化合物的药物组合物,以及用于治疗与A-beta斑块形成和沉积相关的疾病和/或症状的化合物和组合物的用途,这些疾病和症状是由BACE的生物活性引起的。这种由BACE介导的疾病包括,例如,阿尔茨海默病、认知缺陷、认知障碍、精神分裂症和其他中枢神经系统疾病。该发明还提供了一般式(II)和(III)的化合物,以及其亚式形式、中间体和制备本发明化合物的方法。
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表征谱图

  • 氢谱
    1HNMR
  • 质谱
    MS
  • 碳谱
    13CNMR
  • 红外
    IR
  • 拉曼
    Raman
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  • 峰位数据
  • 峰位匹配
  • 表征信息
Shift(ppm)
Intensity
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Assign
Shift(ppm)
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测试频率
样品用量
溶剂
溶剂用量
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