氰基 替莫唑胺 基本信息
| 中文名稱 | 氰基 替莫唑胺 |
|---|---|
| 中文同義詞 | 2-異丙苯基-5-苯基四氮唑;替莫唑胺雜質(zhì)C (EP);替莫唑胺EP雜質(zhì)C;TEMOZOLOMIDE CYANO 雜質(zhì);8-DESCARBOXAMIDO-8-氰基替莫唑胺;3-甲基-4-氧代-3,4-二氫咪唑并[5,1-D][1,2,3,5]四嗪-8-甲腈 (替莫唑胺雜質(zhì));替莫唑胺雜質(zhì)3(替莫唑胺EP雜質(zhì)C) |
| 英文名稱 | Cyano temozolomide |
| 英文同義詞 | Temozolomide Cyano Impurity;Temozolomide Cyano ImpurityQ: What is Temozolomide Cyano Impurity Q: What is the CAS Number of Temozolomide Cyano Impurity Q: What is the storage condition of Temozolomide Cyano Impurity Q: What are the applications of Temozolomide Cyano Impurity;Temozolomide Impurity 3（Temozolomide EP Impurity C）;Imidazo[5,1-d]-1,2,3,5-tetrazine-8-carbonitrile, 3,4-dihydro-3-methyl-4-oxo-;Temozolomide EP Impurity C;Temozolomide Impurity 3(EP-C);8-Descarboxamido-8-cyano Temozolomide;3-Methyl-4-oxo-3,4-dihydroimidazo[5,1-d][1,2,3,5]tetrazine-8-carbonitrile (Temozolomide Impurity) |
| CAS號(hào) | 114601-31-9 |
| 分子式 | C6H4N6O |
| 分子量 | 176.14 |
| EINECS號(hào) | |
| 相關(guān)類別 | 對(duì)照品-雜質(zhì)對(duì)照品;雜質(zhì)對(duì)照品;有機(jī)化學(xué) |
| Mol文件 | 114601-31-9.mol |
| 結(jié)構(gòu)式 |  |
氰基 替莫唑胺 性質(zhì)
| 沸點(diǎn) | 415.3±37.0 °C(Predicted) |
|---|---|
| 密度 | 1.74±0.1 g/cm3(Predicted) |
| 溶解度 | 丙酮（少量溶解）、DMSO（少量溶解）、乙酸乙酯（少量溶解）、甲醇 |
| 酸度系數(shù)(pKa) | -1.85±0.20(Predicted) |
| 形態(tài) | 固體 |
| 顏色 | 淡黃色至淡棕色 |
| InChI | InChI=1S/C6H4N6O/c1-11-6(13)12-3-8-4(2-7)5(12)9-10-11/h3H,1H3 |
| InChIKey | VVSHZIRQNZADET-UHFFFAOYSA-N |
| SMILES | N1(C)C(=O)N2C=NC(C#N)=C2N=N1 |