E1909085计算溶液所需的质量、体积或浓度。
| 活性类型 | 活性值-log(M) | 作用机制 | 期刊 | 参考文献(PubMed IDs) |
|---|
有货
为什么选择此级别
Moligand™ 级 ，适用于对基线干扰要求严格的色谱和分析工作流程。
储存与运输
室温。DG运输 。请查阅批次 COA 获取详细规格。
质量文档
SDS、COA、产品数据表及规格说明书均可下载。可通过批号查询获取批次 COA。
文献证明
在色谱分析、有机合成和交叉偶联反应领域已被 5240 篇同行评审文献引用。
规格
别名
冰醋酸 | 乙酸
规格或纯度
Moligand™, Analytical Volumetric Solution,2.0M
英文名称
Acetate Analytical Titrant
储存条件
室温
运输条件
DG运输
名称和识别符
EC号
200-580-7
分子类型
小分子
IUPAC Name
acetic acid
INCHI
1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)
InChi Key
QTBSBXVTEAMEQO-UHFFFAOYSA-N
Smiles
CC(=O)O
Isomeric SMILES
CC(=O)O
UN Number
Packing Group
II
分子量
60.05
Beilstein号
506007
Reaxy-Rn
506007
Reaxys-RN link address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506007&ln=
技术文档
高级数据
系统学分类
分类树（Taxonomy Tree）
| 界（kingdom) | 有机化合物 |
|---|---|
| 超类（Superclass) | 有机酸及其衍生物 |
| 类（Class) | 羧酸及其衍生物 |
| 亚类（Subclass） | 羧酸 |
| 中间层级节点（Intermediate Tree Nodes） | 暂无 |
| 直接上位类(Direct Parent) | 羧酸 |
| 其他上位类（Alternative Parents） | 一元羧酸及其衍生物 有机氧化物 碳氢化合物衍生物 羰基化合物 |
| 分子骨架（Molecular Framework) | 脂肪族无环化合物 |
| 取代基（Substituents） | 脂肪族非环化合物 - 羰基 - 羧酰胺基 - 烃衍生物 - 单羧酸或其衍生物 - 有机氧化物 - 有机氧化合物 - 有机氧化合物 |
| 描述（Description） | 该化合物属于有机化合物中的羧酸类。这类化合物含有羧基，其化学式为-C(=O)OH。 |
| 外部描述符（External Descriptors） | Straight chain fatty acids |
三维结构
交互式化学结构模型
关联靶点（人）
FFAR2
Tchem
游离脂肪酸受体2(Free fatty acid receptor 2)
(0 活性数据)
FFAR3
Tchem
游离脂肪酸受体3(Free fatty acid receptor 3)
(0 活性数据)
LCK
Tclin
Tyrosine-protein kinase LCK
(9212 活性数据)
FYN
Tclin
Tyrosine-protein kinase FYN
(5308 活性数据)
HCT-116
(91556 活性数据)
SLC16A1
Tchem
Monocarboxylate transporter 1
(146 活性数据)
FFAR3
Tchem
Free fatty acid receptor 3
(304 活性数据)
FFAR2
Tchem
Free fatty acid receptor 2
(545 活性数据)
POLK
Tbio
DNA polymerase kappa
(8653 活性数据)
POLL
Tbio
DNA polymerase lambda
(184 活性数据)
SLCO2B1
Tchem
Solute carrier organic anion transporter family member 2B1
(580 活性数据)
关联靶点（其它种属）
Caenorhabditis elegans (1055 活性数据)
Meloidogyne incognita (862 活性数据)
Mus musculus (284745 活性数据)
RAW264.7 (28094 活性数据)
Radish (446 活性数据)
Lolium rigidum (323 活性数据)
作用机制
| 作用机制 | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | 参考文献 |
|---|
化学和物理性质
密度
1.048
折光率
1.37-1.373
闪点(℃)
40℃
沸点
117-118°C
熔点
16-16.5°C
分子量
60.050 g/mol
XLogP3
-0.200
氢键供体数Hydrogen Bond Donor Count
1
氢键受体数Hydrogen Bond Acceptor Count
2
可旋转键计数Rotatable Bond Count
0
精确质量Exact Mass
60.0211 Da
单同位素质量Monoisotopic Mass
60.0211 Da
拓扑极表面积Topological Polar Surface Area
37.300 Ų
重原子数Heavy Atom Count
4
形式电荷Formal Charge
0
复杂度Complexity
31.000
同位素原子数Isotope Atom Count
0
定义的原子立体中心计数Defined Atom Stereocenter Count
0
未定义的原子立体中心计数Undefined Atom Stereocenter Count
0
定义的键立体中心计数Defined Bond Stereocenter Count
0
未定义的键立体中心计数Undefined Bond Stereocenter Count
0
所有立体化学键的总数The total count of all stereochemical bonds
0
共价键合单元计数Covalently-Bonded Unit Count
1
安全和危险性（GHS）
质检证书（CoA,COO,BSE/TSE 和分析图谱)
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此产品的引用文献
溶液计算器
常见问题
「Moligand?」是什么？
「Moligand?」是阿拉丁科学的高端产品线之一，专为多个工作流程中的高纯度应用而设计。与同类工作流程中的标准级别相比，「Moligand?」产品通常具有更严格的规格、更严谨的 QC 以及更强的批间一致性。
本产品应如何储存？
请于室温条件下保存。
本产品如何运输？
本产品属危险品，通过 FedEx DG Service 运输。不提供陆运及其他经济型服务，部分目的地或地址类型可能受限。
本产品的 CAS 号、分子式和分子量是多少？
本产品的 CAS 号为 64-19-7，分子式为 C2H4O2，分子量为 60.05 g/mol。InChIKey QTBSBXVTEAMEQO-UHFFFAOYSA-N。
如何获取批次专用COA？
每个订单都会随附分析证书（COA），您也可以从账户订单历史中下载。如需订购前的COA，请联系您的客户代表，或使用PDP上的"申请COA"按钮——我们将提供代表性批次的COA。
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