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Methyl-o-methylthiobenzylether | 55102-98-2

中文名称
——
中文别名
——
英文名称
Methyl-o-methylthiobenzylether
英文别名
1-(Methoxymethyl)-2-methylsulfanylbenzene
Methyl-o-methylthiobenzylether化学式
CAS
55102-98-2
化学式
C9H12OS
mdl
——
分子量
168.26
InChiKey
QPZWHYJNYSGDSI-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

  • 沸点:
    228.1±23.0 °C(Predicted)
  • 密度:
    1.05±0.1 g/cm3(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    2.1
  • 重原子数:
    11
  • 可旋转键数:
    3
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.33
  • 拓扑面积:
    34.5
  • 氢给体数:
    0
  • 氢受体数:
    2

反应信息

  • 作为反应物:
    参考文献:
    名称:
    在硫化物氧化中的电子效应,位阻和邻位异构辅助。通过硫-氧非键相互作用的邻域参与
    摘要:
    使用一组硫化物o-和p -XC 6 H 4 SMe,通过动力学方法研究了电子效应,空间位阻和TsNHCl加亲电Cl +和NalO 4进行O-转移的邻位助剂。通过比较邻位和对位取代的化合物的反应性(κ= k o / k p),评估了邻位取代基的空间效应和邻位助剂。对于邻居基团的活性,获得以下顺序:CH 2 OH〜CH 2OME〜CH 2 CO 2我
    DOI:
    10.1039/p29880001123
  • 作为产物:
    参考文献:
    名称:
    Synthesis of p-methylthiobenzyl chloride. Case of isomer control in an electrophilic substitution
    摘要:
    DOI:
    10.1021/jo00901a011
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文献信息

  • HALOALKYLSULFONANILIDE DERIVATIVE
    申请人:Kai Masanori
    公开号:US20120029187A1
    公开(公告)日:2012-02-02
    Novel herbicides are provided. A haloalkylsulfonanilide derivative represented by the formula (1) or an agrochemically acceptable salt thereof: the formula (1): wherein Z is —C(R 9 )(R 10 )— or —N(R 11 )—, A is an oxygen atom, a sulfur atom or —N(R 12 )—, W is an oxygen atom or a sulfur atom, m is an integer of from 0 to 3, n is an integer of from 0 to 3, m+n is from 1 to 3, R 1 is halo C 1 -C 6 alkyl, R 2 is a hydrogen atom, C 1 -C 6 alkyl or the like, each of R 3 and R 4 is independently a hydrogen atom, C 1 -C 6 alkyl or the like, each of R 5 , R 6 , R 7 , R 8 , R 9 and R 10 is independently a hydrogen atom, a halogen, C 1 -C 6 alkyl or the like, each of R 11 and R 12 is a hydrogen atom, C 1 -C 6 alkyl, halo C 1 -C 6 alkyl or the like, and X is independently a hydrogen atom, a halogen, C 1 -C 6 alkyl, or the like.
    提供新型除草剂。 一种由式(1)表示的卤烷基磺酰苯胺生物或其农药可接受的盐: 式(1): 其中Z为—C(R9)(R10)—或—N(R11)—,A为氧原子、原子或—N(R12)—,W为氧原子或原子,m为0至3的整数,n为0至3的整数,m+n为1至3,R1为卤代C1-C6烷基,R2为氢原子、C1-C6烷基或类似物,R3和R4中的每一个独立地为氢原子、C1-C6烷基或类似物,R5、R6、R7、R8、R9和R10中的每一个独立地为氢原子、卤素、C1-C6烷基或类似物,R11和R12中的每一个为氢原子、C1-C6烷基、卤代C1-C6烷基或类似物,X独立地为氢原子、卤素、C1-C6烷基或类似物。
  • Thiadiazole compound and use thereof
    申请人:Ihara Hideki
    公开号:US20060014962A1
    公开(公告)日:2006-01-19
    The thiadiazole compound represented by the formula (A): wherein R 1 represents a C1-C7 alkyl group, a C3-C7 alkenyl group, a C3-C7 alkynyl group and the like; R2 represents a C1-C4 alkyl group substituted with a hetero ring group in which the hetero ring group may be substituted, which the hetero ring group is a five-membered ring containing only an oxygen atom(s) or a sulfur atom(s) as a hetero atom(s); has an excellent arthropod pests controlling activity.
    公式(A)代表的噻二唑化合物,其中R1代表C1-C7烷基,C3-C7烯基,C3-C7炔基等;R2代表被杂环基取代的C1-C4烷基,其中杂环基可以被取代,该杂环基是一个仅包含氧原子或原子作为杂原子的五元环;具有优良的节肢动物害虫控制活性。
  • Thiadiazole compounds and use thereof
    申请人:Ihara Hideki
    公开号:US20050215578A1
    公开(公告)日:2005-09-29
    A thiadiazole compound of the formula (A): wherein R 1 represents methyl, C3-C7 alkenyl, C2-C7 alkoxyalkyl, C2-C7 alkylthioalkyl, C4-C7 alkoxyalkoxyalkyl, C4-C7 alkylthioalkoxyalkyl, phenyl C1-C2 alkyl in which phenyl may be substituted, phenyloxy C1-C2 alkyl in which phenyloxy may be substituted, phenyl C2-C3 alkoxyalkyl in which phenyl may be substituted, or the substituent of the formula (B): wherein R represents C1-C3 alkyl, and R 4 represents a hydrogen atom, methyl, ethyl or phenyl which may be substituted; and R 2 represents phenyl C1-C4 alkyl in which phenyl may be substituted, pyridyl C1-C4 alkyl in which pyridyl may be substituted, or pyrimidyl C1-C4 alkyl in which pyrimidyl may be substituted; has an excellent arthropod pests controlling activity.
    式(A)的噻二唑化合物,其中 R1代表甲基,C3-C7烯基,C2-C7烷氧基烷基,C2-C7烷基烷基,C4-C7烷氧基烷氧基烷基,C4-C7烷基烷氧基烷基,苯基C1-C2烷基,其中苯基可以被取代,苯氧基C1-C2烷基,其中苯氧基可以被取代,苯基C2-C3烷氧基烷基,其中苯基可以被取代,或式(B)的取代基:其中R代表C1-C3烷基,R4代表氢原子,甲基,乙基或苯基,可以被取代;而R2代表苯基C1-C4烷基,其中苯基可以被取代,吡啶基C1-C4烷基,其中吡啶基可以被取代,或嘧啶基C1-C4烷基,其中嘧啶基可以被取代;具有优异的节肢动物害虫控制活性。
  • THIADIAZOLE COMPOUNDS AND USE THEREOF
    申请人:Sumitomo Chemical Company, Limited
    公开号:EP1475374A1
    公开(公告)日:2004-11-10
    A thiadiazole compound of the formula (A): wherein R1 represents methyl, C3-C7 alkenyl, C2-C7 alkoxyalkyl, C2-C7 alkylthioalkyl, C4-C7 alkoxyalkoxyalkyl, C4-C7 alkylthioalkoxyalkyl, phenyl C1-C2 alkyl in which phenyl may be substituted, phenyloxy C1-C2 alkyl in which phenyloxy may be substituted, phenyl C2-C3 alkoxyalkyl in which phenyl may be substituted, or the substituent of the formula (B): wherein R3 represents C1-C3 alkyl, and R4 represents a hydrogen atom, methyl, ethyl or phenyl which may be substituted; and R2 represents phenyl C1-C4 alkyl in which phenyl may be substituted, pyridyl C1-C4 alkyl in which pyridyl may be substituted, or pyrimidyl C1-C4 alkyl in which pyrimidyl may be substituted; has an excellent arthropod pests controlling activity.
    一种式(A)的噻二唑化合物: 其中 R1 代表甲基、C3-C7 烯基、C2-C7 烷氧基烷基、C2-C7 代烷基、C4-C7 烷氧基烷基、C4-C7 代烷氧基烷基、其中苯基可被取代的苯基 C1-C2 烷基、其中苯基氧基可被取代的苯基 C1-C2 烷基、其中苯基可被取代的苯基 C2-C3 烷氧基烷基或式(B)的取代基: 其中 R3 代表 C1-C3 烷基,R4 代表氢原子、甲基、乙基或可被取代的苯基;以及 R2 代表苯基 C1-C4 烷基,其中苯基可被取代,吡啶基 C1-C4 烷基 或嘧啶 C1-C4 烷基,其中嘧啶基可能被取代; 具有极佳的控制节肢动物害虫的活性。
  • THIADIAZOLE COMPOUND AND USE THEREOF
    申请人:Sumitomo Chemical Company, Limited
    公开号:EP1550661A1
    公开(公告)日:2005-07-06
    The thiadiazole compound represented by the formula (A) : wherein R1 represents a C1-C7 alkyl group, a C3-C7 alkenyl group, a C3-C7 alkynyl group and the like; R2 represents a C1-C4 alkyl group substituted with a hetero ring group in which the hetero ring group may be substituted, which the hetero ring group is a five-membered ring containing only an oxygen atom (s) or a sulfur atom(s) as a hetero atom(s); has an excellent arthropod pests controlling activity.
    式(A)代表的噻二唑化合物: 其中 R1 代表 C1-C7 烷基、C3-C7 烯基、C3-C7 炔基或类似基团;R2 代表被杂环基团取代的 C1-C4 烷基,其中杂环基团可被取代,杂环基团是仅含有一个氧原子或一个原子作为杂原子的五元环; 具有极佳的控制节肢动物害虫的活性。
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