化工社化工社 化学情報印刷レポート · 研究参考用
N,N-ジメチル-N'-フェニル-N'-フェニルメチル-1,2-エタンジアミン
N-ベンジル-N',N'-ジメチル-N-フェニルエチレンジアミン · N'-ベンジル-N,N-ジメチル-N'-フェニルエチレンジアミン · N,N-ジメチル-N'-フェニル-N'-フェニルメチル-1,2-エタンジアミン · ブライダル · アンテルガン · ブリダール · レルギチン · フルノー化合物2339RP
識別子と物理属性
| CAS No. | 961-71-7 |
|---|---|
| 分子式 | C17H22N2 |
| 平均分子量 | 254.37 g/mol |
| 単同位体質量 | 254.17829871 g/mol |
| SMILES | CN(C)CCN(Cc1ccccc1)c1ccccc1 |
| InChIKey | CHOBRHHOYQKCOU-UHFFFAOYSA-N |
| PubChem CID | 13751 |
| ChEMBL | CHEMBL157118 |
| ChEBI | CHEBI:135041 |
| DTXSID | DTXSID3043863 |
| 現地名 | N,N-ジメチル-N'-フェニル-N'-フェニルメチル-1,2-エタンジアミン |
化学・物理的性質
| XLogP | 3.7 |
|---|---|
| 極性表面積 | 6.5 |
| 水素結合供与体数 | 0 |
| 水素結合受容体数 | 2 |
| 回転可能結合数 | 6 |
| 重原子数 | 19 |
| 形式電荷 | 0 |
| 複雑度 | 227 |
| 密度 | 1.019 (NTP, 1992) - Denser than waterwill sink1.0160 |
| 沸点 | 354 to 356 °F at 7 mmHg (NTP, 1992)387.59°C (rough estimate) |
| Physical Description | Phenbenzamine is a liquid. (NTP, 1992) |
| 屈折率 | 1.5794 |
| 色 | 淡黄色油 |
| EPAの化学物質情報 | Phenbenzamine (961-71-7) |
安全性と法規制
| 健康有害性 | ACUTE/CHRONIC HAZARDS: Toxic. Hazardous decomposition products. (NTP, 1992) |
|---|---|
| 反応性グループ | Amines, Phosphines, and Pyridines |
| Reactivity Profile | PHENBENZAMINE neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides. |
| Air and Water Reactions | No rapid reaction with air. No rapid reaction with water. |
| 消火 | This compound is not very flammable but any fire involving this compound may produce dangerous vapors. You should evacuate the area. All firefighters should wear full-body protective clothing and use self-contained breathing apparatuses. You should extinguish any fires involving this chemical with a dry chemical, carbon dioxide, foam, or halon extinguisher. (NTP, 1992) |
| 応急処置 | EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop. |
| 非火災時の漏出対応 | SMALL SPILLS AND LEAKAGE: Dampen spilled material with toluene to avoid dust, then transfer material to a suitable container. Use absorbent paper dampened with toluene to pick up remaining material. Wash surfaces well with soap and water. Seal all waste in vapor-tight plastic bags for eventual disposal. |
| Personal Protective Equipment (PPE) | RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992) |
| 毒性 | LDLo ipr-rat: 120 mg/kg BJPCAL 11,1,56 |
用途
来歴
In 1942 phenbenzamine (Antergan), C17H22N2, was the first antihistamine to be successfully used in humans.
一般的な説明
Liquid.