lithium(1+) ion 2-hydroxypropanoate

• ChemBase编号: 102249
• 分子式: C3H5LiO3
• 平均质量: 96.011
• 单一同位素质量: 96.03987357
• SMILES: [Li+].CC(O)C(=O)[O-]
• Canonical SMILES: [O-]C(=O)C(O)C.[Li+]
• InChI: InChI=1S/C3H6O3.Li/c1-2(4)3(5)6;/h2,4H,1H3,(H,5,6);/q;+1/p-1
• InChIKey: GKQWYZBANWAFMQ-UHFFFAOYSA-M

名称和登记号

名称

• IUPAC标准名: lithium(1+) ion 2-hydroxypropanoate
• IUPAC传统名: LithoTab lactate; lithium(1+) ion lactate
• 别名: 乳酸 锂盐; 乳酸锂; DL-乳酸 锂盐; Lactic acid lithium salt; Lithium lactate; Lithium Lactate; DL-LACTIC ACID LITHIUM SALT; LITHIUM LACTATE; DL-Lactic acid lithium salt; Lithium 2-hydroxypropanoate

登记号

• CAS号: 867-55-0; 16891-53-5
• EC号: 212-761-8
• MDL号: MFCD00065399
• Beilstein号: 3568332
• PubChem SID: 24867598; 162088463; 24882238; 24896282
• PubChem CID: 23673452

理论计算性质

• Acid pKa: 3.7849424
• 质子受体: 3
• 质子供体: 1
• LogD (pH = 5.5): -2.1885695
• LogD (pH = 7.4): -3.7410624
• Log P: -0.4718295
• 摩尔折射率: 29.6769 cm^3
• 极化性: 7.4274864 Å^3
• 极化表面积: 60.36 Å^2
• 可自由旋转的化学键: 1
• 里宾斯基五规则: true

分子性质

理化性质

• 溶解度: H2O: soluble0.1 g/mL, clear
• 熔点: >300 °C(lit.)

安全信息

• 保存条件: Room Temperature (15-30°C), Desiccate
• RTECS编号: OJ6311000
• 欧盟危险性物质标志: 刺激性(Irritant) (Xi)
• 德国WGK号: 2; 3
• 危险公开号: R:36/37/38; R:36/37/39
• 安全公开号: 22-24/25; S:26-36
• 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%; ≥97.0% (NT); 95%; 95+%
• 级别: purum
• 线性分子式: CH3CH(OH)COOLi

详细说明

MP Biomedicals - 02100824

Lithium Salt

MP Biomedicals - 05204195

MP Biomedicals Rare Chemical collection

Sigma Aldrich - L1500

Other Notes
Contains approximately equal amounts of DL isomers.

Sigma Aldrich - 440469

包装
50 g in poly bottle