化工社化工社 化学情報印刷レポート · 研究参考用
2,3-フェナジンジアミン
2,3-フェナジンジアミン · 2,3-ジアミノフェナジン · フェナジン-2,3-ジアミン · DAP · AKOS AU36-M329 · 2,3-DIAMINOPHEZINE · 2,3-PHENAZINEDIAMINE · 2,3-diamino-phenazin
識別子と物理属性
| CAS No. | 655-86-7 |
|---|---|
| 分子式 | C12H10N4 |
| 平均分子量 | 210.23 g/mol |
| 単同位体質量 | 210.09054632 g/mol |
| SMILES | Nc1cc2nc3ccccc3nc2cc1N |
| InChIKey | VZPGINJWPPHRLS-UHFFFAOYSA-N |
| PubChem CID | 410099 |
| ChEMBL | CHEMBL274921 |
| EC No. | 211-512-0 |
| DTXSID | DTXSID40984097 |
| 現地名 | 2,3-フェナジンジアミン |
化学・物理的性質
| XLogP | 1.3 |
|---|---|
| 極性表面積 | 77.8 |
| 水素結合供与体数 | 2 |
| 水素結合受容体数 | 4 |
| 回転可能結合数 | 0 |
| 重原子数 | 16 |
| 形式電荷 | 0 |
| 複雑度 | 231 |
| 溶解度 | 5.1 [ug/mL] (The mean of the results at pH 7.4) |
| 融点 | >300 °C |
| 沸点 | 339.76°C (rough estimate) |
| 密度 | 1.2389 (rough estimate) |
| 屈折率 | 1.5000 (estimate) |
| 貯蔵条件 | Keep in dark place,Inert atmosphere,Room temperature |
| pKa（酸解離定数） | 4.24±0.30(Predicted) |
| 外観・状態 | powder |
| 色 | Brown |
| InChI | 1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2 |
| InChIKey | VZPGINJWPPHRLS-UHFFFAOYSA-N |
| SMILES | Nc1cc2nc3ccccc3nc2cc1N |
| CAS データベース | 655-86-7(CAS DataBase Reference) |
化学的特性
Yellow to light brown needle-like crystals
安全性と法規制
| GHS 分類 | This chemical does not meet GHS hazard criteria for 46.2% (37 of 80) of reports.WarningH302 (52.5%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 80 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 規制情報 | 2,3-Phenazinediamine: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
| Hazard Classes and Categories | Acute Tox. 4 (52.5%) |
| 水環境危害等級（WGK） | 3 |
| RTECS 番号 | SG1577650 |
| 毒性 | mic-sat 100 ng/plate MUREAV 227,135,1989 |
| 税関コード | 29339900 |
| 危険文句（R） | 22-36/37/38 |
| 危険表示 | Xn,Xi |
| 安全措置（S） | 26-36/37 |
| 危険等級 | IRRITANTAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3 |
| 貯蔵分類 | 11 - Combustible Solids |
用途
使用
2,3-Phenazinediamine is used for the study on detection of HIV-1 p24 antigen in patients with varying degrees of viremia using ELISA with photochemical signal amplication system.