[(2-hydroxypropanoyl)oxy]ferrio 2-hydroxypropanoate hydrate

• ChemBase编号: 152863
• 分子式: C6H12FeO7
• 平均质量: 252.00028
• 单一同位素质量: 251.99324022
• SMILES: CC(C(=O)O[Fe]OC(=O)C(C)O)O.O
• Canonical SMILES: CC(C(=O)O[Fe]OC(=O)C(O)C)O.O
• InChI: InChI=1S/2C3H6O3.Fe.H2O/c2*1-2(4)3(5)6;;/h2*2,4H,1H3,(H,5,6);;1H2/q;;+2;/p-2
• InChIKey: FDSNKEJXJCZFLE-UHFFFAOYSA-L

名称和登记号

名称

• IUPAC标准名: [(2-hydroxypropanoyl)oxy]ferrio 2-hydroxypropanoate hydrate
• IUPAC传统名: ferrous lactate hydrate
• 别名: 乳酸亚铁 水合物; 乳酸铁(II) 水合物; Ferrous lactate hydrate; Iron(II) lactate hydrate

登记号

• CAS号: 5905-52-2
• EC号: 227-608-0
• Beilstein号: 6099658
• PubChem SID: 24868489; 162247006
• PubChem CID: 71311573

理论计算性质

• Acid pKa: 12.747701
• 质子受体: 4
• 质子供体: 2
• LogD (pH = 5.5): -0.34960002
• LogD (pH = 7.4): -0.34960195
• Log P: -0.3496
• 摩尔折射率: 35.8244 cm^3
• 极化性: 18.063417 Å^3
• 极化表面积: 93.06 Å^2
• 可自由旋转的化学键: 6
• 里宾斯基五规则: true

分子性质

安全信息

• RTECS编号: OD5525000
• 德国WGK号: 2
• 个人保护装置: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

产品相关信息

• 纯度: ≥98.0% (dried material)
• 干燥失重: 12-15% loss on drying
• 线性分子式: [CH3CH(OH)COO]2Fe · xH2O

详细说明

Sigma Aldrich - 44953

包装
100 g in poly bottle
Application

• Reagent in preparation of carbon-based noble-metal-free PEFC cathode catalysts (oxygen reduction) for use in polymer electrolyte fuel cells (PEFCs)1
• Used for iron fortification of food products2
• Used for formulation of chemoattractant coatings for artificial reef structures3