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5-bromobenzo[d][1,3]oxathiole | 82255-55-8

中文名称
——
中文别名
——
英文名称
5-bromobenzo[d][1,3]oxathiole
英文别名
5-Bromo-1,3-benzoxathiole
5-bromobenzo[d][1,3]oxathiole化学式
CAS
82255-55-8
化学式
C7H5BrOS
mdl
——
分子量
217.086
InChiKey
SDWDXWZTQGAJSC-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):
    3
  • 重原子数:
    10
  • 可旋转键数:
    0
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.14
  • 拓扑面积:
    34.5
  • 氢给体数:
    0
  • 氢受体数:
    2

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量
  • 下游产品
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    5-bromobenzo[d][1,3]oxathiole间氯过氧苯甲酸 作用下, 以 氯仿 为溶剂, 反应 24.0h, 以92%的产率得到5-Bromo-1,3-benzoxathiole S-Oxide
    参考文献:
    名称:
    Cabiddu, Salvatore; Cerioni, Giovanni; Cocco, Maria Teresa, Journal of Heterocyclic Chemistry, 1982, vol. 19, p. 135 - 139
    摘要:
    DOI:
  • 作为产物:
    描述:
    1,3-benzoxathiole 以66%的产率得到
    参考文献:
    名称:
    CABIDDU, S.;CERIONI, G.;COCCO, M. T.;MACCIONI, A.;PLUMITALLO, A., J. HETEROCYCL. CHEM., 1982, 19, N 1, 135-139
    摘要:
    DOI:
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文献信息

  • CHROMENE COMPOUND
    申请人:TOKUYAMA CORPORATION
    公开号:US20150034887A1
    公开(公告)日:2015-02-05
    A novel photochromic compound which develops a color of a neutral tint (double peak characteristic) and has high color optical density, high fading speed and excellent durability. Like a compound represented by the following formula (20), the photochromic compound having a group (methylthio group in the following formula 20) which has a sulfur atom bonded to the 7-position carbon atom is a photochromic compound having high color optical density, high fading speed and excellent durability.
    一种新型的光致变色化合物,它会产生一种中性色调(双峰特性),具有高色光密度、快速褪色和优异的耐久性。像以下公式(20)所表示的化合物一样,具有一个含有硫原子与7位碳原子相结合的基团(以下公式20中的甲硫基团)的光致变色化合物,具有高色光密度、快速褪色和优异的耐久性。
  • 4-amino-6-(heterocyclic)picolinates and 6-amino-2-(heterocyclic)pyrimidine-4-carboxylates and their use as herbicides
    申请人:Dow AgroSciences LLC
    公开号:US09149038B2
    公开(公告)日:2015-10-06
    Novel 4-amino-6-(heterocyclic)picolinic acids and their derivatives and 6-amino-2-(heterocyclic)pyrimidine-4-carboxylates and their derivatives are useful to control undesirable vegetation.
    新型的4-氨基-6-(杂环)吡啶酸及其衍生物和6-氨基-2-(杂环)嘧啶-4-羧酸酯及其衍生物可用于控制不良植被。
  • 4-AMINO-6-(HETEROCYCLIC)PICOLINATES AND 6-AMINO-2-(HETEROCYCLIC)PYRIMIDINE-4-CARBOXYLATES AND THEIR USE AS HERBICIDES
    申请人:Dow AgroSciences LLC
    公开号:EP3640249A1
    公开(公告)日:2020-04-22
    Novel 4-amino-6-(heterocyclic)picolinic acids and their derivatives and 6-amino-2-(heterocyclic)pyrimidine-4-carboxylates and their derivatives are useful to control undesirable vegetation.
    新型 4-氨基-6-(杂环)吡啶甲酸及其衍生物和 6-氨基-2-(杂环)嘧啶-4-羧酸及其衍生物可用于控制不良植被。
  • US2014/274701
    申请人:——
    公开号:——
    公开(公告)日:——
  • Bimolecular coupling reactions through oxidatively generated aromatic cations: scope and stereocontrol
    作者:Yubo Cui、Louis A. Villafane、Dane J. Clausen、Paul E. Floreancig
    DOI:10.1016/j.tet.2013.05.011
    日期:2013.9
    Chromenes, isochromenes, and benzoxathioles react with 2,3-dichloro-5,6-dicyano-1,4-benzoquinone to form stable aromatic cations that react with a range of nucleophiles. These oxidative fragment coupling reactions provide rapid access to structurally diverse heterocycles. Conducting the reactions in the presence of a chiral Bronsted acid results in the formation of an asymmetric ion pair that can provide enantiomerically enriched products in a rare example of a stereoselective process resulting from the generation of a chiral electrophile through oxidative carbon hydrogen bond cleavage. (C) 2013 Elsevier Ltd. All rights reserved.
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四碘-2-磺基苯酸酐 四溴-2-磺基苯甲酸环酐 N,N'-二[[(1,3-苯并氧硫杂环戊烷-2-基)硫代]甲基]脲 5-羟基-4,6,7-三甲基-2-丙基-1,3-苯并氧杂噻唑 3-(5-羟基-4,6,7-三甲基-1,3-苯并氧杂噻唑-2-基)丙醇 2-磺基苯甲酸酐 2-(2-甲氧基丙烷-2-基)-7,7-二甲基-4-叔-丁基-8-氧杂-9-硫杂双环[4.3.0]壬-2,4,10-三烯 1,3-苯并噁噻唑,5-甲氧基-,3,3-二氧化 5,7-dimethyl-2-(2,2,2-trifluoro-1-methoxycarbonylethylidene)-1,3-benzooxathiole trans-6-fluoro-2',5-dimethoxy-6'-(trifluoromethyl)spiro[1,3-benzoxathiole-2,1'-cyclohex-2'-en]-4'-one 3,3-dioxide cis-6-fluoro-2',5-dimethoxy-6'-(trifluoromethyl)spiro[1,3-benzoxathiole-2,1'-cyclohex-2'-en]-4'-one 3,3-dioxide trans-2',5-dimethoxy-6'-methylspiro(1,3-benzoxathiole-2,1'-cyclohex-2'-en)-4'-one 3,3-dioxide cis-2',5-dimethoxy-6'-(trifluoromethyl)spiro[1,3-benzoxathiole-2,1'-cyclohex-2'-en]-4'-one 3,3-dioxide (2R,SS)-2-[(1S)-1-(4-methylphenyl)-1-(4-methoxyphenylamino)-methyl]-1,3-benzoxathiole 3(2H)-oxide 3,3-bis<(4-dimethylamino)phenyl>-4H-2,1-benzoxathiole 1-oxide 6-methyl-3,3-bis(4-dimethylaminophenyl)-3H-2,1-benzoxathiole 1-oxide (S)-6-(4-((R)-1-(5-ethylpyrimidin-2-yl)pyrrolidin-3-yl)methoxy-3-fluorophenyl)-2H-benzo[d][1,3]oxathiole 3-oxide 1,3-benzoxathiol-6-ol 1,3-benzoxathiol-6-ol-3-oxide 3,3-dioxido-2H-benzo[d][1,3]oxathiol-6-yl trifluoromethanesulfonate 5-(5-t-butyldimethylsilyloxy-4,6,7-trimethyl-1,3-benzoxathiole-2-yl)-2,2-dimethylpentanoic acid trans-6-fluoro-2',5-dimethoxy-6'-methylspiro(1,3-benzoxathiole-2,1'-cyclohex-2'-en)-4'-one 3,3-dioxide cis-6-fluoro-2',5-dimethoxy-6'-methylspiro(1,3-benzoxathiole-2,1'-cyclohex-2'-en)-4'-one 3,3-dioxide spiro<1,3-benzoxathiole-2,1'-cyclohexane> 3-oxide 4-Amino-3,3-dioxo-3λ6-benz[1,3]oxathiol-5-ol 6-Fluoro-1,3-benzoxathiol-2-amine 3H-2,1-Benzoxathiole 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)- 4-[2-(4-Chloro-phenyl)-benzo[1,3]dithiol-2-yl]-2-[2-(4-chloro-phenyl)-benzo[1,3]oxathiol-2-yl]-1H-pyrrole 5-hydroxy-1,3-benzoxathiole 1,3-Benzoxathiole, 5-(1-(2-(4-chlorophenoxy)ethoxy)ethoxy)- 4-[2-(4-Methoxy-phenyl)-benzo[1,3]dithiol-2-yl]-2-[2-(4-methoxy-phenyl)-benzo[1,3]oxathiol-2-yl]-1H-pyrrole 5-hydroxy-2H-benzo[d][1,3]oxathiole 3,3-dioxide 4-(2-Methyl-benzo[1,3]dithiol-2-yl)-2-(2-methyl-benzo[1,3]oxathiol-2-yl)-1H-pyrrole 2,5-bis<2-(2-tert-butyl-1,3-benzoxathiolyl)>pyrrole 5-bromo-2-phenylbenzo[d][1,3]oxathiole 5-hydroxy-4,6,7-trimethyl-1,3-benzoxathiole 5-Ethoxy-1,1-dioxo-1H-1λ6-benzo[c][1,2]oxathiol-3-one 5-Butoxy-1,1-dioxo-1H-1λ6-benzo[c][1,2]oxathiol-3-one 2-t-Butyl-1,3-benzoxathiole 2-methyl-5'-nitrospiro(3H-2,1-benzoxathiole-1,1'-3H-1,2-benzisothiazole)-3(2H),3'-dione 2,5'-dimethylspiro(3H-2,1-benzoxathiole-1,1'-3H-1,2-benzisothiazole)-3(2H),3'-dione 3,3,3',3'-tetrakis(trifluoromethyl)-1,1'-spirobi<3H-2,1-benzoxathiole> 1-oxide 3-imino-3H-2,1-benzoxathiole-1,1-dioxide Bis-(2-carboxyphenyl)-Schwefel-dihydroxid-dilacton 6-tert-Butyl-1,1,2a,4,4-pentamethyl-2a,4-dihydro-1H-2,3-dioxa-2aλ4-thia-cyclopenta[cd]indene 2,2-dimethyl-6-oxo-8-phenyl-2H,6H-<1,2>thioxolo<4,5,1-hi>benzthioxole 2-(5-Tert-butyl-3,3-dimethyl-2,1-benzoxathiol-7-yl)propan-2-ol 9-tert-Butyl-2,2,4,6,6-pentamethyl-3,5-dioxa-4λ4-thia-tricyclo[5.3.1.04,11]undeca-1(10),7(11),8-triene 4-oxide 2-(5-tert-Butyl-1-chloro-1,3,3-trimethyl-1,3-dihydro-1λ4-benzo[c][1,2]oxathiol-7-yl)-propan-2-ol