Perfluorododecanoic acid (BioDeep_00000182249)
human metabolite blood metabolite Industrial Pollutants
代谢物信息卡片
化学式: C12HF23O2 (613.9609282)
中文名称: 全氟十二酸
谱图信息:
最多检出来源 () 0%
Last reviewed on 2024-10-28.
Cite this Page
Perfluorododecanoic acid. BioDeep Database v3. PANOMIX ltd, a top metabolomics service provider from China.
https://query.biodeep.cn/s/perfluorododecanoic_acid (retrieved
2024-11-13) (BioDeep RN: BioDeep_00000182249). Licensed
under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
分子结构信息
SMILES: OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI: InChI=1S/C12HF23O2/c13-2(14,1(36)37)3(15,16)4(17,18)5(19,20)6(21,22)7(23,24)8(25,26)9(27,28)10(29,30)11(31,32)12(33,34)35/h(H,36,37)
描述信息
Perfluorododecanoic acid, also known as tricosafluorododecanoic acid, is an organic compound containing a perfluorinated carbon chain. This compound is a type of fluoroalkanoic acid, specifically a derivative of dodecanoic acid where all the hydrogen atoms attached to the carbon atoms are replaced by fluorine atoms.
A fluoroalkanoic acid that is dodecanoic acid in which all of the hydrogens attached to carbon atoms are replaced by fluorines. It is a highly persistent, bioaccumulative breakdown product of stain- and grease-proof coatings on food packaging, soft furnishings and carpets.
Chemical Properties
Chemical Formula: C12HF23O2
Molecular Weight: Approximately 614.1 g/mol
CAS Registry Number: 307-55-1
ChEBI ID: CHEBI:90633
Appearance: It is a white powder or chunks.
Physical State: At room temperature, it is a colorless liquid with a distinctive odor.
Chemical Stability: The molecular structure of perfluorododecanoic acid is stable, making it chemically inert under normal conditions. It does not easily undergo chemical reactions at room temperature.
Melting Point: Ranges from 105 to 108°C.
Boiling Point: Approximately 245°C at 740 mmHg.
Density: Estimated to be around 1.7633 g/cm³.
Solubility: It is slightly soluble in chloroform (when heated) and methanol.
Environmental and Health Implications
Perfluorododecanoic acid is known for its persistence and bioaccumulative nature. It is a breakdown product of stain- and grease-proof coatings found on food packaging, soft furnishings, and carpets. This characteristic makes it an environmental contaminant of concern.
Safety Precautions
Hazardous Material: It is classified as a corrosive and irritating substance, posing risks to the eyes, respiratory system, and skin.
Handling Precautions: Recommended safety measures include wearing appropriate protective clothing and immediately washing the eyes with plenty of water in case of contact, followed by medical consultation.
Storage: It should be stored in a refrigerator to maintain stability.
Perfluorododecanoic acid is a chemically stable and environmentally persistent compound, primarily used in industrial applications for its grease and stain-resistant properties. However, its persistence and bioaccumulative nature raise concerns about its environmental impact and potential health hazards.
Perfluorododecanoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=307-55-1 (retrieved 2024-10-28) (CAS RN: 307-55-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
同义名列表
15 个代谢物同义名
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Tricosafluorododecanoic acid; 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Tricosafluorododecanoate; tricosafluorododecanoic acid; Perfluorododecanoic acid; Perfluorododecanoate; perfluorolauric acid; Perfluorolaic acid; Perfluorolaate; N-C11F23COOH; N-C11F23CO2H; PFDoA, C12; C11F23CO2H; C11F23COOH; PFDoA CPD; PFDoA
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代谢反应
0 个相关的代谢反应过程信息。
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1 个相关的物种来源信息
在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有:
- PubMed: 来源于PubMed文献库中的文献信息,我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表,这个列表按照代谢物同时出现的文献数量降序排序,取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
- NCBI Taxonomy: 通过文献数据挖掘,得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序,取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
- Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
- Chemical Reaction: 在化学反应过程中,存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。
点击图上的相关代谢物的名称,可以跳转到相关代谢物的信息页面。