5,7-ジブロモ-8-ヒドロキシキノリン

5,7-ジブロモ-8-ヒドロキシキノリン · コレプル · 5,7-ジブロモオキシン · 5,7-ジブロモ-8-キノリンオール · 8-ヒドロキシ-5,7-ジブロモキノリン · ブロモキシン · 5,7-ジブロモキノリン-8-オール · インテンソパン

https://huagongshe.com/ja/chemical/2453

識別子と物理属性

CAS No.	521-74-4
分子式	C9H5Br2NO
平均分子量	302.95 g/mol
単同位体質量	300.87379 g/mol
SMILES	Oc1c(Br)cc(Br)c2cccnc12
InChIKey	ZDASUJMDVPTNTF-UHFFFAOYSA-N
PubChem CID	2453
ChEMBL	CHEMBL223448
ChEBI	CHEBI:109543
EC No.	208-317-8
DTXSID	DTXSID9045849
現地名	5,7-ジブロモ-8-ヒドロキシキノリン

化学・物理的性質

XLogP	3.2
極性表面積	33.1
水素結合供与体数	1
水素結合受容体数	2
回転可能結合数	0
重原子数	13
形式電荷	0
複雑度	190
SpringerMaterials Properties	Boiling point
Collision Cross Section	137.7 Å² [M+H]+ [CCS Type: TWMethod: calibrated with polyalanine and drug standards]136.76 Å² [M+H]+ [CCS Type: TW
融点	198-200 °C(lit.)
沸点	363.74°C (rough estimate)
密度	2.189
屈折率	1.6400 (estimate)
貯蔵条件	Keep in dark place,Sealed in dry,Room Temperature
溶解度	DMSO（わずかに、超音波処理）、メタノール（わずかに、超音波処理）
外観・状態	個体
pKa（酸解離定数）	2.23±0.30(Predicted)
色	オフホワイトからペールベージュ
Merck	14,1453
BRN	153624
CAS データベース	521-74-4(CAS DataBase Reference)
EPAの化学物質情報	Broxyquinoline (521-74-4)

化学的特性

almost white powder

安全性と法規制

GHS 分類	WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, 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.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
Treatment	EYES: irrigate opened eyes for several minutes under running water. INGESTION: do not induce vomiting. Rinse mouth with water (never give anything by mouth to an unconscious person). Seek immediate medical advice. SKIN: should be treated immediately by rinsing the affected parts in cold running water for at least 15 minutes, followed by thorough washing with soap and water. If necessary, the person should shower and change contaminated clothing and shoes, and then must seek medical attention. INHALATION: supply fresh air. If required provide artificial respiration.
健康影響	Bromine vapour causes irritation and direct damage to the mucous membranes. Elemental bromine also burns the skin. The bromide ion is a central nervous system depressant and chronic exposure produces neuronal effects. This is called bromism and can result in central reactions reaching from somnolence to coma, cachexia, exicosis, loss of reflexes or pathologic reflexes, clonic seizures, tremor, ataxia, loss of neural sensitivity, paresis, papillar edema of the eyes, abnormal speech, cerebral edema, delirium, aggressiveness, and psychoses. (L625, L626, L627)
暴露経路	Oral (L626)inhalation (L626)dermal (L626)
毒性の概要	Bromine is a powerful oxidizing agent and is able to release oxygen free radicals from the water in mucous membranes. These free radicals are also potent oxidizers and produce tissue damage. In additon, the formation of hydrobromic and bromic acids will result in secondary irritation. The bromide ion is also known to affect the central nervous system, causing bromism. This is believed to be a result of bromide ions substituting for chloride ions in the in actions of neurotransmitters and transport systems, thus affecting numerous synaptic processes. (L626, L627, A543)
Signs and Symptoms	Bromine vapour causes irritation and direct damage to the mucous membranes. Symptoms include lacrimation, rhinorrhoea, eye irritation with mucous secretions from the oropharyngeal and upper airways, coughing, dyspnoea, choking, wheezing, epistaxis, and headache. The bromide ion is a central nervous system depressant producing ataxia, slurred speech, tremor, nausea, vomiting, lethargy, dizziness, visual disturbances, unsteadiness, headaches, impaired memory and concentration, disorientation and hallucinations. This is called bromism. (L626, L627)

5,7-ジブロモ-8-ヒドロキシキノリン

識別子と物理属性

化学・物理的性質

化学的特性

安全性と法規制

用途

使用

製法・合成法

純化方法