基本情報
- CAS
532-82-1- 標準SMILES
Cl.Nc1ccc(N=Nc2ccccc2)c(N)c1- InChIKey
MCTQNEBFZMBRSQ-UHFFFAOYSA-N- 分子式
- C12H12N4.ClH
- 平均分子量
- 248.71 g/mol
- 単同位体質量
- 248.0828741
概要
C.i. basic orange 2 appears as red-brown powder, large black shiny crystals with a green luster or purple powder. (NTP, 1992)
名称と識別子
- 優先名称
- C.I. Basic Orange 2
- IUPAC
- 4-phenyldiazenylbenzene-1,3-diamine;hydrochloride
- 現地名
- 2,4-ジアミノアゾベンゼン·塩酸塩
- 英語名
- Basic Orange 2
- 分子式
- C12H12N4.ClH
- 分子量
- 248.71
名称と別名
名称をさらに表示
データベース識別子
- CAS
532-82-1- PubChem CID
- 10771
- DTXSID
DTXSID0024559- ChEMBL
CHEMBL1524085- ChEBI
CHEBI:82424- UNII
- 2431787HMZ
物性
構造計算による物性
- 極性表面積
- 76.8 Ų
- 水素結合供与体数
- 3
- 水素結合受容体数
- 4
- 回転可能結合数
- 2
- 重原子数
- 17
- 形式電荷
- 0
- 複雑度
- 235
実験および物理化学的性質
物理化学的性質
- 融点
- 235 °C · 235 °C (dec.)(lit.)
- 沸点
- 2262 °C · 2262°C
- 比重(密度)
- 1.2171 · 1.2171 (rough estimate)
- 屈折率
- 1.611 · 1.6110 (estimate)
- 貯蔵温度
- room temp
- 溶解性
- 水、エタノール、アセトン、メチルセロソルブ、キシレンに可溶、イソベンゼンにほとんど溶けない
- 外見
- 結晶性粉末
- 酸解離定数(Pka)
- 5.41 · 5.41
- 色
- ボルドー~濃い紫
- 臭い (Odor)
- 無臭
- Merck
- 13 · 13,2279
- BRN
- 3724653 · 3724653
- 主な用途
- 画像記録材料、導波管、薄膜固体、写真材料、印刷版、インク、トナー、洗剤、腐食防止剤、ゴム、繊維、染毛剤
- 化粧品成分の機能
- ヘアカラーリング
- InChI
- 1S/C12H12N4.ClH/c13-9-6-7-12(11(14)8-9)16-15-10-4-2-1-3-5-10;/h1-8H,13-14H2;1H
- InChIKey
- MCTQNEBFZMBRSQ-GEEYTBSJSA-N
- SMILES
- Cl[H].Nc1ccc(N=Nc2ccccc2)c(N)c1
- CAS データベース
- 532 · 532-82-1(CAS DataBase Reference)
- EPAの化学物質情報
- 2 · C.I. Basic Orange 2, monohydrochloride (532-82-1)
化学的性質
化学的特性BORDEAUX TO DEEP PURPLE CRYSTALLINE POWDER
安全と法規制
危険有害性情報
Reactivity Profile
C.I. BASIC ORANGE 2 is an azo compound. Toxic gases are formed by mixing compounds containing azo groups with acids, aldehydes, amides, carbamates, cyanides, inorganic fluorides, halogenated organics, isocyanates, ketones, metals, nitrides, peroxides, phenols, epoxides, acyl halides, and strong oxidizing or reducing agents. Flammable gases are formed by mixing materials in this group with alkali metals. Explosive combination can occur with strong oxidizing agents, metal salts, peroxides, and sulfides. This chemical is incompatible with strong oxidizing agents. (NTP, 1992)
安全と保護具
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 you spill this chemical, you should dampen the solid spill material with water, then transfer the dampened material to a suitable container. Use absorbent paper dampened with water to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Wash all contaminated surfaces 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.
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)
安全データ
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- ST3380000
- ridadr
- UN 3077 9/PG 3
- 毒性
- mma-sat 50 mg/plate MUREAV 44,9,77
- hs_code
- 32129000
- risk_code
- 50/53-68-41-38-22
- hazard_code
- N,Xn
- safety_code
- 60-61-46-36/37/39-26-23
- Hazard Classifications
- Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1Eye Dam. 1Muta. 2Skin Irrit. 2
- ストレージクラス
- 11 - Combustible Solids
- 有毒物質データの
- 532-82-1(Hazardous Substances Data)
化学と産業
用途と製造
応用分野
用途皮革、紙の染色。遊離塩基の形でロウ、プラスチックの着色に使用。
使用Orange dye for cotton and silk.
一般的な説明Red-brown powder, large black shiny crystals with a green luster or purple powder.
調製方法
純化方法It is a red-brown powder which is recrystallised from H2O. It gives a yellow solution in conc H2SO4 which turns orange on dilution. Its solubility at 15o is 5.5% (H2O), 4.75% (EtOH), 6.0% (cellosolve), 9.5% (ethylene glycol), 0.005% (xylene) and is insoluble in *C6H6. The hydroiodide has m 184o (from EtOH) and the picrate forms red needles m 196o. [Muramatsu Bull Chem Soc Jpn 31 864 1958, Beilstein 6 IV 561.]
上流・下流製品情報
上流原料
下流製品
サプライヤー100 社
補足説明
定義A dye made from aniline.
関連反応
化合物ノート
読み込み中…