84661-56-3 (二(1H-咪唑-1-基)甲烷,Di(1H-imidazol-1-yl)methane)

CAS号:
84661-56-3
中文名称:
二(1H-咪唑-1-基)甲烷
英文名称:
Di(1H-imidazol-1-yl)methane
分子式:
C7H8N4
分子量:
148.16522026062

二(1H-咪唑-1-基)甲烷(84661-56-3)名称与标识符

名称

中文别名:
二(1H-咪唑-1-基)甲烷;
英文别名:
1,1'-methylenebis-1H-Imidazole;Di(1H-imidazol-1-yl)methane;N,N-diimidazoylmethane;1-(1H-imidazol-1-ylmethyl)-1H-imidazole;1,1'-methylenediimidazole;AK159782;1-(imidazol-1-ylmethyl)imidazole;Di-1-imidazolylmethane;bis(imidazol-1-yl)methane;Di(1H-imidazole-1-yl)methane;UYHHYFDKCLECEJ-UHFFFAOYSA-N;1H-Imidazole, 1,1'-methylenebis-;FCH2298217;AX8293043;ST24046436;1-[(1H-;1,1′-Methylenebis[1H-imidazole] (ACI);Imidazole, 1,1′-methylenedi- (6CI);1,1-Carbondiimidazole;1,1′-Methylenebis[imidazole];1,1′-Methylenedi-1H-imidazole;1-[(1H-Imidazol-1-yl)methyl]-1H-imidazole;Bis(1H-imidazol-1-yl)methane;Bis(N-imidazolyl)methane;Bizm;Diimidazoles 1,2-di(1H-imidazol-1-yl)methane;N,N-Diimidazolylmethane;SCHEMBL2143890;DA-34909;MFCD00159695;SCHEMBL10385771;DTXSID20233651;AKOS024462346;84661-56-3;InChI=1/C7H8N4/c1-3-10(5-8-1)7-11-4-2-9-6-11/h1-6H,7H;CS-0155615;DS-9687;

标识符

MDL:
MFCD00159695
InChIKey:
UYHHYFDKCLECEJ-UHFFFAOYSA-N
Inchi:
1S/C7H8N4/c1-3-10(5-8-1)7-11-4-2-9-6-11/h1-6H,7H2
SMILES:
N1=CN(CN2C=CN=C2)C=C1

二(1H-咪唑-1-基)甲烷(84661-56-3)物化性质

实验特性

  • LogP : 0.58540
  • PSA : 35.64000
  • 折射率 : 1.655
  • 沸点 : 439.4°C at 760 mmHg
  • 闪点 : 219.5°C
  • 密度 : 1.24

计算特性

  • 精确分子量 : 148.07500
  • 氢键供体数量 : 0
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 2
  • 同位素质量 : 148.075
  • 重原子数量 : 11
  • 复杂度 : 114
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : -0.1
  • 拓扑分子极性表面积 : 35.6

二(1H-咪唑-1-基)甲烷(84661-56-3)安全信息

二(1H-咪唑-1-基)甲烷(84661-56-3)海关数据

海关编码:
2933290090
海关数据:

中国海关编码:

2933290090

概述:

2933290090. 其他结构含非稠合咪唑环的化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素:

品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期

Summary:

2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

二(1H-咪唑-1-基)甲烷(84661-56-3)推荐厂家 更多厂家(23)

公司名称手机号/电话联系人QQ微信询单
上海吉至生化科技有限公司 18117592386
021-57481218
吉至试剂 3007522982
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郑州阿尔法化工有限公司 15324716602
0371-55013243
刘经理 2853979810
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JACS-郑州杰克斯化工产品有限公司 15981966935
0371-86259281
杰克斯JACS 893596907
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上海瀚思化工有限公司 18939883912
021-34536277
顾经理 3003949364
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上海创赛科技有限公司 15021221957
021-59553580
凌度 2852351983
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上海绩祥生物科技有限公司 13093077543陆经理 3985448220
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上海一基实业有限公司 13311756131
021-60548336 QQ:2355265332 QQ:2851717387
胡经理 2355265332
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上海一基实业有限公司 13311756052
021-60526763 13311756052 13311756131
胡经理 2355265332
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赫澎(上海)生物科技有限公司 13122891558
186-16545970
张硕 3418426269
询单
上海腾准生物科技有限公司 19821570922
021-34053661
张经理 3003871136
询单

二(1H-咪唑-1-基)甲烷(84661-56-3)合成路线

合成路线:1 步
反应条件:
参考文献:
Phase transfer catalysis without solvent. Synthesis of bisazolylalkanes
Diez-Barra, Enrique; De la Hoz, Antonio; Sanchez-Migallon, Ana; Tejeda, Juan, Heterocycles, 1992, 34(7), 1365-73
合成路线:1 步
参考文献:
N-Polyazolylmethanes. III. Synthesis and proton NMR study of 1,1'-methylenediimidazole and 1,1'-methylenedibenzimidazole derivatives
Claramunt, Rosa Maria; Elguero, Jose; Meco, Teresa, Journal of Heterocyclic Chemistry, 1983, 20(5), 1245-9
合成路线:1 步
反应条件:
参考文献:
Antibacterial activity of aminals and hemiaminals of pyrazole and imidazole
Lupsor, Simona; Aonofriesei, Florin; Iovu, Mircea, Medicinal Chemistry Research, 2012, 21(10), 3035-3042
合成路线:1 步
反应条件:
参考文献:
Rapid synthesis of azole aminals under microwave heating conditions
Lupsor, Simona; Uivarosi, Valentina; Iovu, Mircea, Revista de Chimie (Bucharest, 2010, 61(3), 333-335
合成路线:1 步
反应条件:
参考文献:
Exploring different coordination modes of the first tetradentate NHC/1,2,3-triazole hybrid ligand for group 10 complexes
Schlagintweit, Jonas F.; Nguyen, Linda; Dyckhoff, Florian; Kaiser, Felix; Reich, Robert M.; et al, Dalton Transactions, 2019, 48(39), 14820-14828
合成路线:1 步
反应条件:
参考文献:
Synthesis of bis(1-imidazolyl)methane
Cai, Juan; Zhao, Taotao; An, Gang; Zhou, Baoying; Hu, Quanyuan, Huaxue Yu Shengwu Gongcheng, 2009, 26(7), 22-24
合成路线:1 步
反应条件:
参考文献:
A highly stable but highly reactive zinc catalyst for transesterification supported by a bis(imidazole) ligand
Nakatake, Daiki; Yokote, Yuki; Matsushima, Yoshimasa; Yazaki, Ryo; Ohshima, Takashi, Green Chemistry, 2016, 18(6), 1524-1530
合成路线:1 步
反应条件:
参考文献:
Linear Pyrazole-bridged Tetra(N-heterocyclic carbene) Ligands and Their Hexanuclear Silver(I) Complexes
Resch, Stefan G.; Dechert, Sebastian; Meyer, Franc, Zeitschrift fuer Anorganische und Allgemeine Chemie, 2019, 645(6-7), 605-612
合成路线:1 步
反应条件:
参考文献:
Defined tetranuclear coinage metal chains
Kaub, Christoph; Lebedkin, Sergei; Bestgen, Sebastian; Koeppe, Ralf; Kappes, Manfred M.; et al, Chemical Communications (Cambridge, 2017, 53(69), 9578-9581
合成路线:1 步
反应条件:
参考文献:
Metallo-Cryptophanes Decorated with Bis-N-Heterocyclic Carbene Ligands: Self-Assembly and Guest Uptake into a Nonporous Crystalline Lattice
Henkelis, James J.; Carruthers, Christopher J.; Chambers, Scott E.; Clowes, Rob; Cooper, Andrew I.; et al, Journal of the American Chemical Society, 2014, 136(41), 14393-14396
合成路线:1 步
反应条件:
参考文献:
Luminescence Sensing of Biomacromolecules Heparin and Protamine in 100% Human Serum and Plasma by Supramolecular Polymeric Assemblies
Biswas, Rakesh; Banerjee, Supratim, Biomacromolecules, 2023, 24(2), 766-774
合成路线:1 步
反应条件:
参考文献:
Syntheses of Symmetric and Unsymmetric Bis-imidazole Derivatives Using Phase-Transfer Catalysis
Zhang, Kun-Peng; Jin, Tian-Qi; Zhou, Jun-Qiang; Ma, Ting-Ting; Jin, Chuan-Ming, Journal of Heterocyclic Chemistry, 2017, 54(6), 3065-3070
合成路线:1 步
反应条件:
参考文献:
Acetate-Selective Anion Receptor with Methylene-Bridged Bis-Imidazolium Rings
In, Sungjae; Kang, Jongmin, Journal of Inclusion Phenomena and Macrocyclic Chemistry, 2006, 54(1-2), 129-132
合成路线:1 步
反应条件:
参考文献:
Fluorescent anion receptor with two methylene bridged bis-imidazolium ring on anthracene
In, Sungjae; Kang, Jongmin, Bulletin of the Korean Chemical Society, 2005, 26(7), 1121-1124
合成路线:1 步
反应条件:
参考文献:
Iodide selective fluorescent anion receptor with two methylene bridged bis-imidazolium rings on naphthalene
Kim, Hyungil; Kang, Jongmin, Tetrahedron Letters, 2005, 46(33), 5443-5445
合成路线:1 步
反应条件:
参考文献:
Nickel and Platinum PCP Pincer Complexes Incorporating an Acyclic Diaminoalkyl Central Moiety Connecting Imidazole or Pyrazole Rings
Puerta Lombardi, Braulio M.; Brown, Rudy M.; Gendy, Chris; Chang, Chia Yun; Chivers, Tristram; et al, Organometallics, 2017, 36(17), 3250-3256
合成路线:1 步
反应条件:
参考文献:
N-Heterocyclic Carbene-Iridium Complexes as Photosensitizers for In Vitro Photodynamic Therapy to Trigger Non-Apoptotic Cell Death in Cancer Cells
Wang, Xing; Zhang, Chen; Madji, Ryma; Voros, Camille; Mazeres, Serge; et al, Molecules, 2023, 28(2),
合成路线:1 步
反应条件:
参考文献:
Synthesis, crystal structures, in vitro anticancer, and in vivo acute oral toxicity studies of bis-imidazolium/benzimidazolium salts and respective dinuclear Ag(I)-N-heterocyclic carbene complexes
Haque, Rosenani A.; Hasanudin, Noorhafizah; Iqbal, Muhammad Adnan; Ahmad, Ashfaq; Hashim, Suzana; et al, Journal of Coordination Chemistry, 2013, 66(18), 3211-3228
合成路线:1 步
反应条件:
参考文献:
Dimeric Gold Bis(carbene) Complexes by Transmetalation in Water
Cure, Jeremy; Poteau, Romuald; Gerber, Iann C.; Gornitzka, Heinz; Hemmert, Catherine, Organometallics, 2012, 31(2), 619-626
合成路线:1 步
反应条件:
参考文献:
Synthesis of Di(imdazolium) and Di(pyrazolium) Salts as Precursors for N-heterocyclic Dicarbene Complexes
Goncharova, Tatiana V.; Zatonskaya, Lina V.; Potapov, Andrei S., Procedia Chemistry, 2014, 10, 485-489

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