(4S,5S)-二氢-5-甲基-2-苯基-4-噁唑羧酸甲酯 基本信息
| 中文名称 | (4S,5S)-二氢-5-甲基-2-苯基-4-噁唑羧酸甲酯 |
|---|---|
| 中文同义词 | (4S,5S)-二氢-5-甲基-2-苯基-4-噁唑羧酸甲酯;(4S,5S)-二氢-5-甲基-2-苯基-4-唑羧酸甲酯;(4S,5S)-二氢-5-甲基-2-苯基-4噁唑羧酸甲酯 |
| 英文名称 | METHYL (4S,5S)-DIHYDRO-5-METHYL-2-PHENYL-4-OXAZOLECARBOXYLATE |
| 英文同义词 | METHYL (4S,5S)-DIHYDRO-5-METHYL-2-PHENYL-4-OXAZOLECARBOXYLATE;methyl (4S,5S)-dihydro-5-methyl-2-phenyl-4-oxazol;methyl dihydro-5-methyl-2-phenyl-4-oxazolecarboxylate;4-Oxazolecarboxylic acid, 4,5-dihydro-5-methyl-2-phenyl-, methyl ester, (4S,5S)-;Methyl (4S,5S)-dihydro-5-methyl-2-phenyl-4-oxazolecarboxylate |
| CAS号 | 82659-84-5 |
| 分子式 | C12H13NO3 |
| 分子量 | 219.24 |
| EINECS号 | |
| 相关类别 | Chiral Building Blocks;Heterocyclic Building Blocks;Oxazoles |
| Mol文件 | 82659-84-5.mol |
| 结构式 |  |
(4S,5S)-二氢-5-甲基-2-苯基-4-噁唑羧酸甲酯 性质
| 熔点 | 74-76 °C (lit.) |
|---|---|
| 沸点 | 110-115 °C/0.01 mmHg (lit.) |
| 密度 | 1.1825 (rough estimate) |
| 折射率 | 1.5270 (estimate) |
| 酸度系数(pKa) | 2.66±0.70(Predicted) |
| 旋光度 (Optical Rotation) | [α]19/D +66°, c = 8 in ethanol |
| InChI | 1S/C12H13NO3/c1-8-10(12(14)15-2)13-11(16-8)9-6-4-3-5-7-9/h3-8,10H,1-2H3/t8-,10-/m0/s1 |
| InChIKey | YBKQIWQAEPMIFG-WPRPVWTQSA-N |
| SMILES | COC(=O)[C@H]1N=C(O[C@H]1C)c2ccccc2 |
| 提供商 | 语言 |
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