4-(1H-1,2,4-三唑-1-甲基)苯甲酸
| 中文名称 | 4-(1H-1,2,4-三唑-1-甲基)苯甲酸 |
|---|---|
| 中文同义词 | 4-(1H-1,2,4-三唑-1-甲基)苯甲酸;4-(1H-1,2,4-噻唑-1-甲基)苯甲酸;4-((1H-1,2,4-三唑-1-基)甲基)苯甲酸盐酸盐;4-(1H-1,2,4-三唑-1-基甲基)苯甲酸盐酸盐;4-(1H-1,2,4-三唑-1-甲基)苯甲酸 10G;4〔1,2,4〕三唑-1-甲基甲基苯甲酸;4-(1H-1,4-(1H-1,2,4-三唑-1-甲基)苯甲酸2,4-TRIAZOL-1-YLMETHYL)BENZOIC ACID;4-((1H-1,2,4-三唑-1-基)甲基)苯甲酸 |
| 英文名称 | 4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZOIC ACID |
| 英文同义词 | 4-[1,2,4]TRIAZOL-1-YLMETHYL-BENZOIC ACID;4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZOIC ACID;4-(1H-1,2,4-triazol-1-ylmethyl)benzoic acid hydrochloride;benzoic acid, 4-(1H-1,2,4-triazol-1-ylmethyl)-;4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZOIC ACID（WS204223）;DK7716;DK7444;4- (1H-1,2,4-triazole-1-methyl) benzoic acid |
| CAS号 | 160388-54-5 |
| 分子式 | C10H9N3O2 |
| 分子量 | 203.2 |
| EINECS号 | |
| 相关类别 | 其它;Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts;Carboxylic Acids;Phenyls & Phenyl-Het;Carboxylic Acids;Phenyls & Phenyl-Het |
| Mol文件 | 160388-54-5.mol |
| 结构式 |  |
4-(1H-1,2,4-三唑-1-甲基)苯甲酸 性质
| 熔点 | 227 °C |
|---|---|
| 沸点 | 456.9±55.0 °C(Predicted) |
| 密度 | 1.34±0.1 g/cm3(Predicted) |
| 储存条件 | 2-8°C |
| 酸度系数(pKa) | 4.14±0.10(Predicted) |
| 外观 | 白色至灰白色固体 |
| InChI | InChI=1S/C10H9N3O2/c14-10(15)9-3-1-8(2-4-9)5-13-7-11-6-12-13/h1-4,6-7H,5H2,(H,14,15) |
| InChIKey | DJXUEFGFCMIONN-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC=C(CN2C=NC=N2)C=C1 |
可作为配体用于合成MOF材料
参考文献
[1] Construction of Metal–Organic Frameworks (M = Cd(II), Co(II), Zn(II), and Cu(II)) Based on Semirigid Oxadiazole Bridging Ligands by Solution and Hydrothermal Reactions. https://doi.org/10.1021/cg060583安全信息
| 危险品标志 | Xi |
|---|---|
| 危险等级 | IRRITANT |
| 更新日期 | 产品编号 | 产品名称 | CAS号 | 包装 | 价格 |
|---|---|---|---|---|---|
| 2017/11/01 | CC45701CB | 4-(1H-1,2,4-三唑-1-甲基)苯甲酸 4-(1H-1,2,4-triazol-1-ylmethyl)benzoic acid | 160388-54-5 | 250MG | 609元 |
| 2017/11/01 | CC45701DA | 4-(1H-1,2,4-三唑-1-甲基)苯甲酸 4-(1H-1,2,4-triazol-1-ylmethyl)benzoic acid | 160388-54-5 | 1GR | 1634元 |