化工社化工社 化学情報印刷レポート · 研究参考用
二塩化N,N-ジメチル-M-フェニレンジアンモニウム
N,N-ジメチル-M-フェニレンジアミン二塩酸塩 · 二塩化N,N-ジメチル-M-フェニレンジアンモニウム · N,N‐ジメチル‐M‐フェニレンジアミン二塩酸塩 · N,N-ジメチル-M-フェニレンジアミン, 二塩酸塩 · N,N-ジメチルベンゼン-1,3-ジアミン二塩酸塩 · N,N-ジメチル-1,3-フェニレンジアミン 二塩酸塩 · 二塩化Ｎ,Ｎ-ジメチル-ｍ-フェニレンジアンモニウム(二塩酸Ｎ,Ｎ-ジメチル-ｍ-フェニレンジアミン) · N,N-DIMETHYL-1,3-PHENYLENEDIAMINE DIHYDROCHLORIDE
識別子と物理属性
| CAS No. | 3575-32-4 |
|---|---|
| 分子式 | C8H14Cl2N2 |
| 平均分子量 | 209.11 g/mol |
| 単同位体質量 | 208.0534038 g/mol |
| SMILES | CN(C)c1cccc(N)c1.Cl.Cl |
| InChIKey | BZJPIQKDEGXVFG-UHFFFAOYSA-N |
| PubChem CID | 77124 |
| EC No. | 222-693-0 |
| DTXSID | DTXSID9063089 |
| 現地名 | 二塩化N,N-ジメチル-M-フェニレンジアンモニウム |
化学・物理的性質
| 極性表面積 | 29.3 |
|---|---|
| 水素結合供与体数 | 3 |
| 水素結合受容体数 | 2 |
| 回転可能結合数 | 1 |
| 重原子数 | 12 |
| 形式電荷 | 0 |
| 複雑度 | 101 |
| 融点 | 217-220 °C (dec.) |
| 貯蔵条件 | Keep in dark place,Inert atmosphere,Room temperature |
| 溶解度 | 水：可溶100mg/2ml、透明～やや濁り（微黄色～黄褐色～紫色）水、クロロホルム、ジクロロメタンに可溶。酢酸エチルにやや溶ける。 |
| 外観・状態 | 結晶性 |
| 色 | オフホワイトからタン |
| BRN | 3694384 |
| 安定性 | 安定。酸、酸化剤とは相容れない。 |
| InChI | 1S/C8H12N2.2ClH/c1-10(2)8-5-3-4-7(9)6-8/h3-6H,9H2,1-2H32*1H |
| InChIKey | BZJPIQKDEGXVFG-UHFFFAOYSA-N |
| SMILES | Cl.Cl.CN(C)c1cccc(N)c1 |
| CAS データベース | 3575-32-4(CAS DataBase Reference) |
| EPAの化学物質情報 | 1,3-Benzenediamine, N,N-dimethyl-, dihydrochloride (3575-32-4) |
化学的特性
Off-White Crystalline Solid
安全性と法規制
| GHS 分類 | DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]H311 (13.3%): Toxic in contact with skin [Danger Acute toxicity, dermal]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H317 (86.7%): May cause an allergic skin reaction [Warning Sensitization, Skin]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P262, P264, P264+P265, P270, P271, P272, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P333+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| 規制情報 | Chemical: 1,3-Benzenediamine, N,N-dimethyl-, dihydrochloride1,3-Benzenediamine, N,N-dimethyl-, dihydrochloride: Does not have an individual approval but may be used under an appropriate group standard |
| その他の安全情報 | Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia |
| Hazard Classes and Categories | Acute Tox. 3 (100%)Acute Tox. 3 (13.3%)Skin Irrit. 2 (100%)Skin Sens. 1 (86.7%)Eye Irrit. 2 (100%)STOT SE 3 (100%) |
| F | 3-8-10 |
| 水環境危害等級（WGK） | 3 |
| TSCA 収載状態 | TSCA listed |
| 輸送番号（UN） | UN 2811 6.1/PG 2 |
用途
使用
it can be used to produce N-(4,5,6-trimethoxy-2,4-dimethyl-tetrahydro-pyran-3-yl)-formamide with 4,5,6-trimethoxy-2,4-dimethyl-tetrahydro-pyran-3-ylamine. This reaction will need solvent tetrahydrofuran. it is applied as a selective formylating agent for one of two amino groups in such basic amino acids as ornithine or lysine.