sodium butanoate

• ChemBase编号: 72833
• 分子式: C4H7NaO2
• 平均质量: 110.08695
• 单一同位素质量: 110.03437375
• SMILES: CCCC(=O)O[Na]
• Canonical SMILES: CCCC(=O)O[Na]
• InChI: InChI=1S/C4H8O2.Na/c1-2-3-4(5)6;/h2-3H2,1H3,(H,5,6);/q;+1/p-1
• InChIKey: MFBOGIVSZKQAPD-UHFFFAOYSA-M

名称和登记号

名称

• IUPAC标准名: sodium butanoate
• IUPAC传统名: butanoic acid, sodium salt
• 别名: Butyric acid sodium salt; Sodium butyrate

登记号

• CAS号: 156-54-7
• PubChem SID: 162037754
• PubChem CID: 5222465

理论计算性质

• 质子受体: 1
• 质子供体: 0
• LogD (pH = 5.5): 1.1678
• LogD (pH = 7.4): 1.1678
• Log P: 1.1678
• 摩尔折射率: 20.944 cm^3
• 极化性: 10.551695 Å^3
• 极化表面积: 26.3 Å^2
• 可自由旋转的化学键: 3
• 里宾斯基五规则: true

分子性质

理化性质

• 溶解度: DMSO

安全信息

• 保存条件: -20°C

产品相关信息

• 成盐信息: Butyrate

详细说明

Selleck Chemicals - S1999

Research Area: Cancer
Biological Activity:
Sodium butyrate is a compound with formula Na(C3H7COO). It is the sodium salt of butyric acid. It has various effects on cultured mammalian cells including inhibition of proliferation, induction of differentiation and induction or repression of gene expression. As such, it can be used in lab to bring about any of these effects. Specifically, butyrate treatment of cells results in histone hyperacetylation, and butyrate itself inhibits HDAC activity. Butyrate has been an essential vehicle for determining the role of histone acetylation in chromatin structure and function. Inhibition of HDAC activity affects the expression of only 2% of mammalian genes. [1]

参考文献

• http://en.wikipedia.org/wiki/Sodium_butyrate