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Pentyl-o-tolylether | 33426-63-0

中文名称
——
中文别名
——
英文名称
Pentyl-o-tolylether
英文别名
1-Methyl-2-pentoxybenzene
Pentyl-o-tolylether化学式
CAS
33426-63-0
化学式
C12H18O
mdl
——
分子量
178.274
InChiKey
LFSXJBLCEDZNLL-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

计算性质

  • 辛醇/水分配系数(LogP):
    4.5
  • 重原子数:
    13
  • 可旋转键数:
    5
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.5
  • 拓扑面积:
    9.2
  • 氢给体数:
    0
  • 氢受体数:
    1

反应信息

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文献信息

  • Phenylalanine derivative and proteinase inhibitor
    申请人:Okamoto, Shosuke
    公开号:EP0284632A1
    公开(公告)日:1988-10-05
    A phenylalanine derivative having the formula (I): wherein A represents (a) H2N-, (b) or B represents (a) (b) or wherein m is 0, 1, or 2 and n is 3, 4, or 5; X represents (a) hydroxy, (b) nitro, (c) amino, (d) phenoxy which may be substituted with (i) halogen or (ii) nitro, (e) C1-C4 alkyloxy which may be substituted with (i) phenyl or (ii) benzoyl, (f) benzoyl, (g) pyridyloxy which may be substituted with (i) halogen or (ii) nitro, or (h) C1-C4 alkyl which may be substituted with halogen; Y represents or -OR3 wherein R1 and R2 are independently (a) hydrogen, (b) phenyl which may be substituted with (i) benzoyl, (ii) C1-C4 alkylcarbonyl, (iii) C1-C4 alkyl which may be further substituted with C1-C4 alkoxycarbonyl or hydroxycarbonyl, (iv) C2-Cs alkenyl which may be further substituted with hydroxycarbonyl or C1-C4 alkoxycarbonyl, (v) C1-C4 alkoxycarbonyl, or (vi) amidino, (c) pyridyl which may be substituted with halogen or carboxyl (d) imidazolyl, (e) pyrimidyl, (f) tetrazolyl, (g) thiazolyl which may be substituted with C,-C4 alkyl which may be further substituted with C1-C4 alkoxycarbonyl, (h) C1-C6 alkyl which may be substituted with C1-C4 alkoxy, C1-C4 alkoxycarbonyl, phenyl, or benzoyl, (i) CS-C7 cycloalkyl which may be substituted with C1-C4 alkoxycarbonyl or (j) R' and R2 may form, with the nitrogen atom attached thereto, (i) pyperazyl which may be substituted on the nitrogen atom with C1-C4 alkyl which may be further substituted with phenyl, (ii) piperidino which may be substituted with carboxyl or C1-C4 alkoxycarbonyl, (iii) pyrrolidyl which may be substituted with C1-C4 alkoxycarbonyl, or (iv) morpholyl; and R3 represents (a) hydrogen, (b) C1-C6 alkyl which may be substituted with (i) C1-C4 alkoxy, (ii) phenyl, or (iii) pyridyl, or (c) pyridyl; or a pharmaceutically acceptable acid salt thereof. This phenylalanine derivative is effective as a proteinase.
    具有以下式(I)的苯丙酸衍生物:其中A代表(a)H2N-,(b)或B代表(a)(b)或其中m为0、1或2,n为3、4或5;X代表(a)羟基,(b)硝基,(c)基,(d)苯氧基,其可以被(i)卤素或(ii)硝基取代,(e)C1-C4烷氧基,其可以被(i)苯基或(ii)苯甲酰基取代,(f)苯甲酰基,(g)吡啶氧基,其可以被(i)卤素或(ii)硝基取代,或(h)C1-C4烷基,其可以被卤素取代;Y代表或-OR3,其中R1和R2独立地为(a)氢,(b)苯基,其可以被(i)苯甲酰基,(ii)C1-C4烷基羰基,(iii)C1-C4烷基,其可以进一步被C1-C4烷氧羰基或羟基羰基取代,(iv)C2-Cs烯烃基,其可以进一步被羟基羰基或C1-C4烷氧羰基取代,(v)C1-C4烷氧羰基,或(vi)酰胺基,(c)吡啶基,其可以被卤素或羧基取代(d)咪唑基,(e)嘧啶基,(f)四唑基,(g)噻唑基,其可以被C1-C4烷基取代,其可以进一步被C1-C4烷氧羰基取代,(h)C1-C6烷基,其可以被C1-C4烷氧基,C1-C4烷氧羰基,苯基或苯甲酰基取代,(i)C5-C7环烷基,其可以被C1-C4烷氧羰基取代或(j)R'和R2可以与其连接的氮原子形成(i)哌嗪基,其可以在氮原子上被C1-C4烷基取代,其可以进一步被苯基取代,(ii)哌啶基,其可以被羧基或C1-C4烷氧羰基取代,(iii)吡咯基,其可以被C1-C4烷氧羰基取代,或(iv)吗啉基;R3代表(a)氢,(b)C1-C6烷基,其可以被(i)C1-C4烷氧基,(ii)苯基或(iii)吡啶基取代,或(c)吡啶;或其药学上可接受的酸盐。该苯丙酸衍生物作为蛋白酶具有有效性。
  • An Efficient Copper-Catalyzed Etherification of Aryl Halides
    作者:Jinkun Huang、Ying Chen、Johann Chan、Mike Ronk、Robert Larsen、Margaret Faul
    DOI:10.1055/s-0030-1260761
    日期:2011.6
    An efficient and mild copper-catalyzed ether formation from aryl halides and aliphatic alcohols has been developed. The key to the successful coupling is the use of lithium alkoxide, directly or in situ generated by lithium tert-butoxide, and the corresponding alcohol as solvent.
    已经开发出一种由芳基卤化物和脂肪醇形成的有效且温和的催化醚形成。成功偶联的关键是使用由叔丁醇锂直接或原位生成的醇,以及相应的醇作为溶剂。
  • Indole Compound and Use Thereof
    申请人:Takeuchi Jun
    公开号:US20080188532A1
    公开(公告)日:2008-08-07
    The present invention relates to a compound represented by the formula (I), wherein all symbols are as defined in the description, a salt thereof, a solvate thereof, or a prodrug thereof, which has a leukotriene receptor antagonistic activity which is expected to be more effective than those of the leukotriene receptor antagonists currently used in clinical trials. Therefore, it is useful as an agent for the prevention and/or treatment of a leukotriene-mediated disease such as a respiratory diseases such as bronchial asthma, chronic obstructive pulmonary disease, pulmonary emphysema, chronic bronchitis, pneumonia (e.g. interstitial pneumonia etc.), severe acute respiratory syndrome (SARS), acute respiratory distress syndrome (ARDS), allergic rhinitis, sinusitis (e.g. acute sinusitis, chronic sinusitis, etc.), or the like, or as an expectorant or an antiitussive.
    本发明涉及一种化合物,其表示为公式(I),其中所有符号如描述中所定义,其盐,溶剂化物或前药,具有期望比目前在临床试验中使用的白三烯受体拮抗剂更有效的白三烯受体拮抗作用。因此,它可用作预防和/或治疗白三烯介导的疾病,例如呼吸系统疾病,如支气管哮喘,慢性阻塞性肺疾病,肺气肿,慢性支气管炎,肺炎(例如间质性肺炎等),严重急性呼吸综合征(SARS),急性呼吸窘迫综合征(ARDS),过敏性鼻炎,鼻窦炎(例如急性鼻窦炎,慢性鼻窦炎等),或作为祛痰剂或止咳剂。
  • AZOLYLMETHYLIDENEHYDRAZINE DERIVATIVE AND USE THEREOF
    申请人:Ogura Hironobu
    公开号:US20100190754A1
    公开(公告)日:2010-07-29
    An azolylmethylidenehydrazine derivative represented by the formula (I) wherein Ar is an aryl group optionally having substituent(s) or a heteroaryl group optionally having substituent(s), R 1 and R 2 are the same or different and each is an alkyl group, a cycloalkyl group, an aralkyl group optionally having substituent(s), an aryl group optionally having substituent(s), a heteroarylalkyl group optionally having substituent(s), or R 1 and R 2 are bonded to each other to form a nitrogen-containing heterocyclic group optionally having substituent(s), and X is CH or a nitrogen atom, or a pharmacologically acceptable salt thereof is useful as a medicament, particularly as an antifungal agent, or an anti-inflammatory agent or an antiallergic agent.
    一种以式(I)表示的氮杂环甲基亚唑啉衍生物,其中Ar是一个芳基基团,可选择地具有取代基,或者是一个杂芳基基团,可选择地具有取代基;R1和R2相同或不同,每个都是一个烷基基团、环烷基基团、可选择地具有取代基的芳基烷基基团、可选择地具有取代基的芳基基团、可选择地具有取代基的杂芳基烷基基团,或者R1和R2彼此连接形成一个可选择地具有取代基的含氮杂环基团;X是CH或氮原子;或其药学上可接受的盐,可用作药物,特别是作为抗真菌药物、抗炎药物或抗过敏药物。
  • SOLVENT SOAPS AND METHODS EMPLOYING SAME
    申请人:UNION OIL COMPANY OF CALIFORNIA
    公开号:EP0735919A1
    公开(公告)日:1996-10-09
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