10-Undecynoic Acid - ≥98%(GC) , CAS No.2777-65-3

CAS: 2777-65-3 Cat. No.: U162912 分子式: C₁₁H₁₈O₂ 分子量: 182.26 Beilstein Registry Number: 1704920 EC番号: 220-471-8 PubChem CID: 31039

GRADE & PURITY ≥98%(GC)

Synonyms

Undec-10-ynoic acid | BRN 1704918 | LCZC1163 | AKOS001592014 | AS-57177 | DTXSID2075219 | Undec-1-yn-11-oic acid | LMFA01030618 | SCHEMBL40510 | Q18611669 | 10-Undecynoic acid | 2F79G7H1WY | UNII-2F79G7H1WY | CHEBI:185054 | 10-HENDECYNOIC ACID | Hendecyno

Storage

Room temperature

Shipped In

Normal

概要

10-Undecynoic acid (10- UDYA, UDY) is an acetylenic fatty acid. It is reported as highly selective irreversible inhibitor of hepatic ω- and ω-1-lauric acid hydroxylases. Enzyme catalyzed esterification of 10-undecynoic acid has been reported. UDY has been reported to be synthesized by the dehydrobromination of 10-undecenoic acid.

10-Undecynoic acid was employed as model compound to investigate the microwave assisted surface click reactions catalyzed with Cu(II)/sodium L-ascorbate.

It may be used:

· As a biochemical probe in an assay for the microsomal hydroxylation of lauric acid (LA), based on HPLC with flow-through radiochemical detection. 

· To form molecular layers by adsorbing on the fluorite surface. 

· In the supercritical hydrothermal synthesis of iron oxide nanoparticles.

Specifications

同義語

Undec-10-ynoic acid | BRN 1704918 | LCZC1163 | AKOS001592014 | AS-57177 | DTXSID2075219 | Undec-1-yn-11-oic acid | LMFA01030618 | SCHEMBL40510 | Q18611669 | 10-Undecynoic acid | 2F79G7H1WY | UNII-2F79G7H1WY | CHEBI:185054 | 10-HENDECYNOIC ACID | Hendecyno

仕様と純度

≥98%(GC)

保管条件

Room temperature

入荷

Normal

純度

≥98%(GC)

名前と識別子

• パブケム・シド: 504753420
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/504753420
• カノニカル・スマイル: C#CCCCCCCCCC(=O)O
• IUPAC Name: undec-10-ynoic acid
• InChIKey: OAOUTNMJEFWJPO-UHFFFAOYSA-N
• INCHI: 1S/C11H18O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h1H,3-10H2,(H,12,13)
• 異性体SMILES: C#CCCCCCCCCC(=O)O
• WGKドイツ: 3
• RTECS: YQ3683000
• PubChem CID: 31039
• 分子量: 182.26
• Beilstein: 1704920
• Reaxy-Rn: 1704918

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • 分類 Fatty Acyls
      • Subclass Fatty acids and conjugates

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 分類: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Medium-chain fatty acids
• Alternative Parents: Unsaturated fatty acids Straight chain fatty acids Monocarboxylic acids and derivatives Carboxylic acids Acetylides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Medium-chain fatty acid - Unsaturated fatty acid - Straight chain fatty acid - Acetylide - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
• External Descriptors: Unsaturated fatty acids

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

化学的性質と物理的性質

• 溶解度: Sparingly Soluble in water.
• 引火点（°F）: 235.4 °F
• 引火点（°C）: 113 °C
• 沸点（°C）: 180 °C/15 mmHg
• 融点（°C）: 43 °C
• 分子量: 182.260 g/mol
• XLogP3: 3.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 182.131 Da
• Monoisotopic Mass: 182.131 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 176.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

参考文献

1. Quan Nie, Junpeng Fan, Rui Xu, Zhiwei Yao, Yuqi Xiao, Chaoyu Xiang, Lei Qian, Ting Zhang.  (2025)  Direct Optical Patterning of Quantum Dot Light-Emitting Diodes Based on Ultrafast, Low-Energy, Site-Controlled Click Chemistry Reaction.  ADVANCED FUNCTIONAL MATERIALS,      [PMID:] [10.1002/adfm.202420829]