dipotassium ({[(dioxotriboroxan-3-yl)oxy]({[({[(oxoboranyl boronato)oxy][(oxoboranyl)oxy]boranyl}oxy)borinato]oxy})boranyl}oxy)(oxo)borane octahydrate

• ChemBase编号: 104540
• 分子式: B10H21K2O24
• 平均质量: 591.45894
• 单一同位素质量: 593.06274391
• SMILES: O.O.O.O.O.O.O.O.[K+].[K+].[O-]B(O[BH]=O)OB(O[BH]=O)OB([O-])OB(O[BH]=O)OB(O[BH]=O)O[BH]=O
• Canonical SMILES: O=[BH]OB(OB(OB(OB(O[BH]=O)O[BH]=O)O[BH]=O)[O-])OB(O[BH]=O)[O-].O.O.O.O.O.O.O.O.[K+].[K+]
• InChI: InChI=1S/B10O16.2K.8H2O/c11-1-18-6(16)23-9(21-4-14)24-7(17)25-10(22-5-15)26-8(19-2-12)20-3-13;;;;;;;;;;/h;;;8*1H2/q-2;2*+1
• InChIKey: AXTXIARPFKLBPW-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: dipotassium ({[(dioxotriboroxan-3-yl)oxy]({[({[(oxoboranyl boronato)oxy][(oxoboranyl)oxy]boranyl}oxy)borinato]oxy})boranyl}oxy)(oxo)borane octahydrate
• IUPAC传统名: dipotassium ion ({[(dioxotriboroxan-3-yl)oxy][({[(oxoboranyl boronato)oxy][(oxoboranyl)oxy]boranyl}oxyborinato)oxy]boranyl}oxy)(oxo)borane octahydrate
• 别名: POTASSIUM PENTABORATE OCTAHYDRATE

登记号

• CAS号: 11128-29-3
• EC号: 234-371-7
• PubChem SID: 162092782
• PubChem CID: 44134903

理论计算性质

• Acid pKa: 8.262202
• 质子受体: 11
• 质子供体: 0
• LogD (pH = 5.5): 10.610654
• LogD (pH = 7.4): 10.554674
• Log P: 10.6114
• 摩尔折射率: 22.2521 cm^3
• 极化性: 27.31614 Å^3
• 极化表面积: 214.54 Å^2
• 可自由旋转的化学键: 18
• 里宾斯基五规则: false

分子性质

安全信息

• 保存条件: Room Temperature (15-30°C)

产品相关信息

• 纯度: >99.5%

详细说明

MP Biomedicals - 02156341

Octahydrate
Purity: >99.5%
Crystalline
pH of a 1% solution of 25°C = 8.4.