4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯

• 常用名: 4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯
• 英文名: ethyl 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate
• CAS号: 53715-64-3
• 分子量: 247.31300
• 密度: 1.188g/cm3
• 沸点: 150ºC
• 分子式: C₁₃H₁₃NO₂S
• 熔点: 36-39ºC
• 闪点: 179.3ºC

4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯名称

• 中文名: 4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯
• 英文名: ethyl 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate
• 中文别名: 2-苯基-4-甲基噻唑-5-甲酸乙酯 | 4-甲基-2-苯基-1,3-噻唑-5-羧酸乙酯

4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯物理化学性质

• 密度: 1.188g/cm3
• 沸点: 150ºC
• 熔点: 36-39ºC
• 分子式: C₁₃H₁₃NO₂S
• 分子量: 247.31300
• 闪点: 179.3ºC
• 精确质量: 247.06700
• PSA: 67.43000
• LogP: 3.29520
• InChIKey: FYPLITQTMHJFKK-UHFFFAOYSA-N
• SMILES: CCOC(=O)c1sc(-c2ccccc2)nc1C
• 折射率: 1.572
• 储存条件: -20°C，干燥
• 分子结构:

  1、 摩尔折射率：68.55

  2、 摩尔体积（cm³/mol）：208.0

  3、 等张比容（90.2K）：278.5

  4、 表面张力（dyne/cm）：45.4

  5、 极化率（10-24cm3）：27.17

• 计算化学:

  1.疏水参数计算参考值（XlogP）:3.6

  2.氢键供体数量:0

  3.氢键受体数量:4

  4.可旋转化学键数量:4

  5.互变异构体数量:无

  6.拓扑分子极性表面积67.4

  7.重原子数量:17

  8.表面电荷:0

  9.复杂度:266

  10.同位素原子数量:0

  11.确定原子立构中心数量:0

  12.不确定原子立构中心数量:0

  13.确定化学键立构中心数量:0

  14.不确定化学键立构中心数量:0

  15.共价键单元数量:1

• 更多:

  1.熔点（°C）：36

  2.沸点（°C）：150

4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯MSDS

4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯MSDS英文版

4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯安全信息

• 危害码 (欧洲): Xn: Harmful;
• 风险声明 (欧洲): R22;R36/37/38
• 安全声明 (欧洲): S22-S26-S36/37/39
• 海关编码: 2934100090

4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯海关

• 海关编码: 2934100090
• 中文概述: 2934100090. 结构上含有一个非稠合噻唑环的化合物(不论是否氢化). 增值税率:17.0%. 退税率:9.0%. 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
• Summary: 2934100090 other compounds containing an unfused thiazole ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯靶点实验

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4-甲基-2-苯基-1,3-噻唑-5-甲酸乙酯英文别名

• ethyl 2-phenyl-4-methylthiazole-5-carboxylate
• MFCD00141953
• 4-Methyl-2-phenyl-thiazol-5-carbonsaeure-aethylester
• 5-Aethoxycarbonyl-4-methyl-2-phenyl-thiazol
• 5-Ethoxycarbonyl-4-methyl-2-phenyl-thiazol
• 4-methyl-2-phenyl-thiazole-5-carboxylic acid ethyl ester
• ethyl 4-methyl-2-phenylthiazole-5-carboxylate