基本情報
- CAS
25834-80-4- 標準SMILES
Nc1ccc(Cc2ccc(N)c(Cc3ccc(N)cc3)c2)cc1- InChIKey
KKVLCJIOPNYOQN-UHFFFAOYSA-N- 分子式
- C20H21N3
- 平均分子量
- 303.4 g/mol
- 単同位体質量
- 303.17354768
概要
2,4-bis(p-aminobenzyl)aniline is a brown solid. (NTP, 1992)
名称と識別子
- 優先名称
- 2,4-Bis(p-aminobenzyl)aniline
- IUPAC
- 2,4-bis[(4-aminophenyl)methyl]aniline
- 現地名
- 2,4-ビス[(4-アミノフェニル)メチル]アニリン
- 英語名
- 2,4-bis(p-aminobenzyl)aniline
- 分子式
- C20H21N3
- 分子量
- 303.4
名称と別名
2,4-Bis(p-aminobenzyl)anilineCCRIS 5970Benzenamine, 2,4-bis[(4-aminophenyl)methyl]-EINECS 247-291-2BRN 28802912,4-bis(4-aminobenzyl)anilineBenzenamine, 2,4-bis((4-aminophenyl)methyl)-2,4-BIS((4-AMINOPHENYL)METHYL)BENZENAMINEDTXSID80246064-[2-Amino-5-(4-aminobenzyl)benzyl]phenylamine2,4-Bis[(4-aminophenyl)methyl]benzenamine4-(2-Amino-5-(4-aminobenzyl)benzyl)phenylamine
名称をさらに表示
2,4-ビス(4-アミノベンジル)アニリン2,4-ビス[(4-アミノフェニル)メチル]アニリン2,4-ビス(p-アミノベンジル)アニリン2,4-Bis-(p-aminobenzyl)-anilin2,4-Bis[(4-aminophenyl)methyl]aniline
RefChem:82220DTXCID0046063-(P-AMINOBENZYL)-4,4'-DIAMINODIPHENYLMETHANEALPHA,ALPHA'-BIS(P-AMINOPHENYL)-2,4-XYLIDINE2,4-XYLIDINE, ALPHA,ALPHA'-BIS(P-AMINOPHENYL)-247-291-2KKVLCJIOPNYOQN-UHFFFAOYSA-N25834-80-4
データベース識別子
- CAS
25834-80-4
物性
構造計算による物性
- XLogP
- 3.7
- 極性表面積
- 78.1 Ų
- 水素結合供与体数
- 3
- 水素結合受容体数
- 3
- 回転可能結合数
- 4
- 重原子数
- 23
- 形式電荷
- 0
- 複雑度
- 343
実験および物理化学的性質
Solubilityless than 1 mg/mL at 70.7 °F (NTP, 1992)
Physical Description2,4-bis(p-aminobenzyl)aniline is a brown solid. (NTP, 1992)
物理化学的性質
- 融点
- 133 · 133-135 °C
- 沸点
- 434.33 °C · 434.33°C (rough estimate)
- 比重(密度)
- 1.0837 · 1.0837 (rough estimate)
- 屈折率
- 1.6 · 1.6000 (estimate)
- 酸解離定数(Pka)
- 5.16 · 5.16±0.25(Predicted)
- 安定性
- 強酸化剤、強酸とは相容れない。
- CAS データベース
- 25834 · 25834-80-4
- EPAの化学物質情報
- 2 · 2,4-Bis(p-aminobenzyl)aniline (25834-80-4)
化学的性質
化学的特性brown solid
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
危険有害性情報
Regulatory InformationChemical: Benzenamine, 2,4-bis[(4-aminophenyl)methyl]-
Fire HazardsFlash point data for this chemical are not available, however it is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this compound may include irritation of the skin and mucous membranes.
Reactive GroupAmines, Aromatic
Reactivity Profile2,4-BIS(P-AMINOBENZYL)ANILINE can react with strong acids and oxidizing agents. (NTP, 1992)
Air and Water Reactionsit may be sensitive to air and/or light. Insoluble in water.
安全と保護具
Fire FightingFires involving this compound can be controlled using a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid
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.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If a spill of this chemical occurs, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with acetone and transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
化学と産業
用途と製造
General Manufacturing InformationBenzenamine, 2,4-bis[(4-aminophenyl)methyl]-: ACTIVE
応用分野
一般的な説明Brown solid.
サプライヤー2 社
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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化合物ノート
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