λ5-bismuthio(3+) ion pentahydrate trinitrate

• ChemBase编号: 105732
• 分子式: BiH10N3O14
• 平均质量: 485.0715
• 单一同位素质量: 484.99667502
• SMILES: O.O.O.O.O.[Bi+3].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-]
• Canonical SMILES: [O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].O.O.O.O.O.[Bi+3]
• InChI: InChI=1S/Bi.3NO3.5H2O/c;3*2-1(3)4;;;;;/h;;;;5*1H2/q+3;3*-1
• InChIKey: FBXVOTBTGXARNA-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: λ^5-bismuthio(3+) ion pentahydrate trinitrate; bismuth(3+) ion tris(nitrooxidane) pentahydrate; bismuth(3+) ion pentahydrate trinitrate
• IUPAC传统名: λ^5-bismuthio(3+) ion pentahydrate trinitrate; bismuth(3+) ion pentahydrate trinitronate; bismuth(3+) ion pentahydrate trinitrate
• 别名: 硝酸铋(III) 五水合物; 硝酸铋(III), Puratronic®; 五水合硝酸铋(III), ACS; 五水合硝酸铋(III); Bismuth trinitrate pentahydrate; Bismuth(III) nitrate pentahydrate; Bismuth(III) nitrate hydrate, Puratronic®; Bismuth(III) nitrate pentahydrate, ACS; BISMUTH NITRATE; BISMUTH NITRATE PENTAHYDRATE ACS REAGENT GRADE

登记号

• CAS号: 10035-06-0; 10361-44-1
• EC号: 233-791-8; 231-177-4
• MDL号: MFCD00149157; MFCD00003460
• 默克索引号: 141271
• PubChem SID: 24854938; 24855361; 24870440; 24863932; 162092576
• PubChem CID: 160911

理论计算性质

• Acid pKa: -1.3999903
• 质子受体: 3
• 质子供体: 0
• LogD (pH = 5.5): 0.8368004
• LogD (pH = 7.4): 0.8368004
• Log P: 0.8368004
• 摩尔折射率: 8.3471 cm^3
• 极化性: 3.4222581 Å^3
• 极化表面积: 66.2 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: Soluble in dilute HNO3 acid solution. Decomposes in water to subnitrate. Soluble in dilute acetic acid, glycerol, acetone. Insoluble in alcohol, ethyl acetate
• 外观: Crystalline
• 熔点: 30 °C(lit.); 30°C dec.
• 沸点: 75-80 °C(lit.)
• 密度: 2.83; 2.830 g/ml
• 蒸汽压: 1 mm Hg at 1021 °C

安全信息

• 保存条件: Room Temperature (15-30°C)
• 保存注意事项: Hygroscopic
• RTECS编号: EB2984430
• 欧盟危险性物质标志: 氧化性(Oxidising) (O); 刺激性(Irritant) (Xi)
• 联合国危险货物编号: 1477; UN1477
• 德国WGK号: 2
• 联合国危险货物等级: 5.1
• 联合国危险货物包装类别(PG): 2; II
• 澳大利亚Hazchem: 1Z
• 危险公开号: 8-36/37/38; R:8-36/37/38
• 安全公开号: 17-26-36; 17-26-37-60; S:17-20-25-26-37/39
• 欧盟危险货物分类: O2
• 欧盟危险识别号(EUHIN): 5.1B
• 美国ERG指导号: 140
• TSCA收录: 是
• GHS危险品标识: GHS03; GHS07
• GHS警示词: Danger
• GHS危险声明: H272-H315-H319-H335
• GHS警示性声明: P220-P261-P305 + P351 + P338; P221-P210-P305+P351+P338-P302+P352-P405-P501A
• 个人保护装置: dust mask type N95 (US), Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges; Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 1477 5.1/PG 2

产品相关信息

• 纯度: ≥98.0%; ≥98.0% (KT); ≥98.5% (complexometric); ≥99.5%; ≥99.99% trace metals basis; 98%; 99.999% (metals basis); 99.999% trace metals basis
• 级别: ACS; ACS reagent; JIS special grade; puriss.; purum p.a.; REAGENT; reagent grade
• 杂质: <100 ppm total metallic impurities; ≤0.005% insolubles
• 痕量阳离子: Ag: ≤0.001%; Ag: ≤10 mg/kg; As: ≤0.001%; Ca: ≤0.005%; Ca: ≤20 mg/kg; Ca: ≤50 mg/kg; Cd: ≤50 mg/kg; Co: ≤50 mg/kg; Cu: ≤0.002%; Cu: ≤10 mg/kg; Cu: ≤50 mg/kg; Fe: ≤0.001%; Fe: ≤10 mg/kg; Fe: ≤50 mg/kg; K: ≤0.01%; K: ≤100 mg/kg; K: ≤20 mg/kg; Mg: ≤20 mg/kg; Na: ≤0.02%; Na: ≤100 mg/kg; Na: ≤20 mg/kg; Ni: ≤50 mg/kg; Pb: ≤0.002%; Pb: ≤20 mg/kg; Pb: ≤50 mg/kg; Zn: ≤10 mg/kg; Zn: ≤50 mg/kg
• 痕量阴离子: chloride (Cl-): ≤0.001%; chloride (Cl-): ≤10 mg/kg; chloride (Cl-): ≤50 mg/kg; sulfate (SO42-): ≤0.005%; sulfate (SO42-): ≤100 mg/kg; sulfate (SO42-): ≤50 mg/kg
• 品质说明: crystallized
• 线性分子式: Bi(NO3)3 · 5H2O

详细说明

MP Biomedicals - 02193883

ACS Reagent Grade
Purity: 98%
Pentahydrate

MP Biomedicals - 05206662

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 467839

包装
50, 250 g in poly bottle
Application
各种 4-取代的 Hantzsch 1,4-二氢吡啶的优质氧化剂。1将硫化物选择性氧化成亚砜的简便试剂。2

Sigma Aldrich - 248592

包装
100, 500 g in poly bottle
Application
各种 4-取代的 Hantzsch 1,4-二氢吡啶的优质氧化剂。1将硫化物选择性氧化成亚砜的简便试剂。2

Sigma Aldrich - 254150

包装
25 g in glass bottle
Application
各种 4-取代的 Hantzsch 1,4-二氢吡啶的优质氧化剂。1将硫化物选择性氧化成亚砜的简便试剂。2

Sigma Aldrich - 383074

Application
各种 4-位取代-1,4-二氢吡啶汉斯酯的优良氧化剂。1将硫化物选择性氧化成亚砜的简便试剂。2
包装
100, 500 g in poly bottle

参考文献

• Useful, easily handled oxidizing and nitrating agent in organic synthesis. Montmorillonite KSF acidic clay impregnated with bismuth nitrate was found to be an excellent reagent for high-yield aromatic nitration: Tetrahedron Lett., 41, 8017 (2000). Phenols can be nitrated with the salt itself in acetone, or without solvent: J. Org. Chem., 70, 9071 (2005). In the presence of montmorillonite, alcohols can be oxidized to carbonyl compounds: Synth. Commun., 31, 2691 (2001). Reagent for deprotection of oximes: Synthesis, 1010 (2001), and hydrazones: Synth. Commun., 32, 1917 (2001). Thioamides and thioureas are readily converted to their oxo-analogs: Tetrahedron Lett., 44, 591 (2003).
• Catalyst for a convenient, high-yield Michael addition of various substrates, including amines, imidazoles and indoles, to enones: J. Org. Chem., 68, 2109 (2003). Efficient catayst for tetrahydropyranylation and depyranylation of alcohols: Eur. J. Org. Chem., 4891 (2005).
• For a brief feature on uses of the reagent in organic synthesis, see: Synlett, 2699 (2005).