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(6E)-6-[(6-Chloro-2-methyl-2H-indazol-5-yl)imino]-3-[(1-methyl-1H-1,2,4-triazol-3-yl)methyl]-1-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4-dione(CAS: 2647530-73-0)
![(6E)-6-[(6-Chloro-2-methyl-2H-indazol-5-yl)imino]-3-[(1-methyl-1H-1,2,4-triazol-3-yl)methyl]-1-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4-dione](https://cnstatic.chemtradehub.com/structs/264/2647530-73-0-0106.webp "(6E)-6-[(6-Chloro-2-methyl-2H-indazol-5-yl)imino]-3-[(1-methyl-1H-1,2,4-triazol-3-yl)methyl]-1-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4-dione")
CAS号
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其他供应商提供的 (6E)-6-[(6-Chloro-2-methyl-2H-indazol-5-yl)imino]-3-[(1-methyl-1H-1,2,4-triazol-3-yl)methyl]-1-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4-dione
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![(6E)-6-[(6-Chloro-2-methyl-2H-indazol-5-yl)imino]-3-[(1-methyl-1H-1,2,4-triazol-3-yl)methyl]-1-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4-dione — 上海源叶生物科技有限公司](https://cnstatic.chemtradehub.com/suppliers/67ce9f132b2de6e8e95a48fe/67ce9f132b2de6e8e95a48fe-logo.webp){kind=logo}
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基本信息
分子式
C22H17ClF3N9O2
分子量
531.89 g/mol
化学标识符
SMILES
CN1C=C2C=C(/N=C3\NC(=O)N(CC4=NN(C)C=N4)C(=O)N\3CC3C=C(F)C(F)=CC=3F)C(Cl)=CC2=N1
InChIKey
QMPBBNUOBOFBFS-UHFFFAOYSA-N
数据库引用
常见问题
该化合物为白色或类白色固体，具有较高的熔点和较低的挥发性。分子量为626.07 g/mol。它在有机溶剂如二氯甲烷、乙腈中溶解良好，在水中溶解度低。在化学反应中显示出良好的反应活性，尤其是在与三氟甲基相关的反应中表现出较高的亲和力。
该化合物通常通过三氟苄基亲核取代反应合成。首先，将2,4,5-三氟苄基卤化物与5-氯-2-甲基-2H-吲唑-6-甲醛缩合生成中间体，然后与1-甲基-1H-1,2,4-三唑-3-基甲醇反应生成最终产品。该合成路线产率较高，通常可达80%以上。
该化合物主要应用于医药行业，作为潜在的抗癌药物中间体。此外，它还可能在聚合物合成和传感器技术中有所应用，但具体的工业应用仍在研发阶段。
处理此化合物时，应佩戴适当的个人防护装备，包括防化学品手套、防护眼镜和防护服。应在通风橱中进行操作。如果发生泄露，应立即使用大量水冲洗，避免吸入蒸汽。参阅安全数据表（SDS）以获取更详细的安全操作信息。
安全须知
使用前请验证产品规格和安全数据。联系供应商获取详细安全信息。
请始终遵循正确的操作程序
联系信息
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