quinolin-8-ol

• ChemBase编号: 85390
• 分子式: C9H7NO
• 平均质量: 145.15798
• 单一同位素质量: 145.05276385
• SMILES: n1cccc2cccc(c12)O
• Canonical SMILES: Oc1cccc2c1nccc2
• InChI: InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H
• InChIKey: MCJGNVYPOGVAJF-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: quinolin-8-ol
• IUPAC传统名: 8 hydroxyquinoline
• 别名: 8-氢氧化喹啉; 8-羟基喹啉; 8-羟基氮杂萘; 喔星; 8-羟基喹啉; 8-羟基喹啉, ACS; 8-Hydroxychinolin; 8-Oxyquinoline; 8-Quinol; AQ+; Albisal; Fennosan H 30; Oxin; Oxoquinoline; Oxychinolin; Oxyquinoline; Phenopyridine; Tumex; NSC 2039; NSC 285166; NSC 402623; NSC 48037; NSC 54230; NSC 615011; NSC 82404; NSC 82405; NSC 82409; NSC 82410; NSC 82412; quinolin-8-ol; 1-azanaphthalene-8-ol; Fennosan H 30, hydroxybenzopyridinl; hoxybenzopyridinl; oxychinolil; oxyquinolinl; phenopyridinl; quinophenol; Quinolin-8-ol; 8-Hydroxyquinoline; 8-Hydroxyquinoline; 8-Oxychinolin; Oxine; 8-QUINOLINOL; 8-QUINOLINOL, ACS; 8-QUINOLINOL; 8-Hydroxyquinoline; 8-Quinolinol; 8-Hydroxyquinoline, ACS

登记号

• CAS号: 148-24-3
• EC号: 205-711-1
• MDL号: MFCD00006807
• Beilstein号: 114512
• 默克索引号: 144843
• PubChem SID: 24855220; 24898938; 24862497; 24859483; 24853168; 162072506; 24895771; 24879139
• PubChem CID: 1923
• CHEBI ID: 48981
• ATC码: G01AC30; R02AA14; A01AB07; D08AH03
• CHEMBL: 310555
• Chemspider ID: 1847
• KEGG ID: D05321
• 美国药典/FDA物质标识码: 5UTX5635HP
• 维基百科标题: 8-Hydroxyquinoline

理论计算性质

• Acid pKa: 9.3576975
• 质子受体: 2
• 质子供体: 1
• LogD (pH = 5.5): 1.7469306
• LogD (pH = 7.4): 1.8207314
• Log P: 1.8273351
• 摩尔折射率: 41.9602 cm^3
• 极化性: 17.599808 Å^3
• 极化表面积: 33.12 Å^2
• 可自由旋转的化学键: 0
• 里宾斯基五规则: true

分子性质

理化性质

• 溶解度: Almost insoluble in water and diethyl ether. Highly soluble in ethanol, acetone, chloroform, and benzene.; Chloroform
• 外观: crystalline; Granular; Pale Pale Yellow Solid; White crystalline needles
• 熔点: 55-58°C; 70-73 °C(lit.); 70-74 °C; 70-76 °C; 70-76°C; 72 - 74°C; 72°C; 72.5-74 °C; 72.5-75 °C; 72-74 °C; 72-74°C; 72-74°C; 72-76°C; 76°C
• 沸点: 266.6 °C @ 752 mm; 267 °C/752 mmHg(lit.); 267°C; 267°C/252mm; 267°C; 276°C
• 密度: 1.03; 1.034 g/cm^3
• 疏水性(logP): 2.077

安全信息

• 保存条件: Refrigerator, Under Inert Atmosphere; Room Temperature (15-30°C), Protect from light
• 保存注意事项: Harmful/Irritant/Mutagenic/Light Sensitive/Air Sensitive/Store under Argon; Light Sensitive
• RTECS编号: VC4200000
• 欧盟危险性物质标志: X; 有害性(Harmful) (Xn)
• 德国WGK号: 3
• 危险公开号: 22; 22-68; R:22
• 安全公开号: 36/37; 9-36/37; S:36/37/39
• TSCA收录: 是
• GHS危险品标识: GHS07; GHS08
• GHS警示词: Warning
• 主要危害: flammable
• GHS危险声明: H302; H341-H302
• GHS警示性声明: P281-P264-P301+P312-P308+P313-P405-P501A
• 个人保护装置: dust mask type N95 (US), Eyeshields, Faceshields, Gloves

产品相关信息

• 纯度: ≥99%; ≥95.0% (NT); ≥99%; ≥99% (perchloric acid titration); ≥99.0%; ≥99.0% (NT); 95%; 97%; 98%; 99%
• 级别: ACS; ACS reagent; ACS reagent, reag. Ph. Eur.; analytical standard; JIS special grade; PESTANAL®, analytical standard; puriss. p.a.; purum; REAGENT
• 包装: ampule of 1000 mg
• 适用性: passes test for suitability for Mg decision
• 燃烧残渣: ≤0.05%; ≤0.05% (as SO4)
• 杂质: ≤0.05% insol. Alcohol; ≤0.05% insoluble in ethanol
• 痕量阴离子: chloride (Cl-): ≤10 mg/kg; chloride (Cl-): ≤20 mg/kg; sulfate (SO42-): ≤0.02%; sulfate (SO42-): ≤100 mg/kg
• 品质说明: for the detection and determination of Al, Mg and others
• Empirical Formula (Hill Notation): C9H7NO

详细说明

MP Biomedicals - 05213232

MP Biomedicals Rare Chemical collection

MP Biomedicals - 02152569

ACS Reagent Grade

MP Biomedicals - 02151310

Free Base
Purity: 99+%
Light yellow crystals

Sigma Aldrich - H58307

Application
螯合剂

Sigma Aldrich - 252565

包装
50, 250 g in glass bottle

Sigma Aldrich - 36524

法律信息
PESTANAL 注册商标 Sigma-Aldrich Laborchemikalien GmbH

Sigma Aldrich - H6878

Application
Used as a lipophilic monoprotic bidentate chelating agent.
Biochem/physiol Actions
RNA 合成抑制剂，可作为杀灭须癣毛癣菌、疣孢漆斑菌和绿色木霉菌的杀真菌剂。抗真菌反应机理不明确，但与结构有关。
包装
25, 100, 500 g in glass bottle

Sigma Aldrich - 164984

Application
金属螯合剂
包装
100 g in glass bottle

参考文献

• Chelating ligand.