6-methoxyquinoline - ≥96% , CAS No.5263-87-6

CAS: 5263-87-6 Cat. No.: M105654 Formula: C₁₀H₉NO Peso molecolare: 159.18 Beilstein Registry Number: 115244 Numero EC: 226-077-2

GRADE & PURITY ≥96%

Synonyms

FEMA NO. 4640 | EN300-23867 | Methyl 6-quinolyl ether | HY-W017232 | FT-0621202 | MFCD00006800 | SB67501 | AMY21891 | STR09836 | AC-18179 | InChI=1/C10H9NO/c1-12-9-4-5-10-8(7-9)3-2-6-11-10/h2-7H,1H | FS-3598 | H10211 | AI3-16316 | BBL027610 | Z166628264 |

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinonimi

FEMA NO. 4640 | EN300-23867 | Methyl 6-quinolyl ether | HY-W017232 | FT-0621202 | MFCD00006800 | SB67501 | AMY21891 | STR09836 | AC-18179 | InChI=1/C10H9NO/c1-12-9-4-5-10-8(7-9)3-2-6-11-10/h2-7H,1H | FS-3598 | H10211 | AI3-16316 | BBL027610 | Z166628264 |

Specifiche e purezza

≥96%

Condizioni di conservazione di stoccaggio

Protected from light,Room temperature,Argon charged

Spedito in

Normal

Purezza

≥96%

Nomi e identificatori

• Pubchem Sid: 488182037
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488182037
• Sorrisi canonici: COC1=CC2=C(C=C1)N=CC=C2
• IUPAC Name: 6-methoxyquinoline
• InChIKey: HFDLDPJYCIEXJP-UHFFFAOYSA-N
• INCHI: 1S/C10H9NO/c1-12-9-4-5-10-8(7-9)3-2-6-11-10/h2-7H,1H3
• Isomeri SMILES: COC1=CC2=C(C=C1)N=CC=C2
• WGK Germania: 3
• Peso molecolare: 159.18
• Beilstein: 115244
• Reaxy-Rn: 115244
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=115244&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Quinolines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Quinolines and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinolines and derivatives
• Alternative Parents: Anisoles Alkyl aryl ethers Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinoline - Anisole - Alkyl aryl ether - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as quinolines and derivatives. These are compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene.
• External Descriptors: aromatic ether - quinolines

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

Obiettivi associati (umani)

ACHE Tclin Acetylcholinesterase (18204 Activities)

Discover Target: ACHE

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in Alcohol
• Sensibilità: air sensitive ；light sensitive
• Punto di congelamento (°C): 20 °C
• Indice di rifrazione: 1.625
• Punto di infiammabilità (°F): 235.4 °F
• Punto di infiammabilità (°C): 113 °C
• Punto di ebollizione (°C): 140-146 °C/15 mmHg
• Punto di fusione (°C): 18-20°C
• Peso molecolare: 159.180 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 159.068 Da
• Monoisotopic Mass: 159.068 Da
• Topological Polar Surface Area: 22.100 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 149.000
• 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

Riferimenti

1. Qingqing Li, Zhiwei Sun, Yilin Wei, Zixu Ma, Liucheng Wang, Renfeng Nie.  (2024)  Acceptorless ambient-temperature dehydrogenation and reversible hydrogenation of N-heterocycles over single-atom Co-N-C catalysts.  APPLIED CATALYSIS B-ENVIRONMENTAL,      [PMID:] [10.1016/j.apcatb.2024.123959]

2. Xingyue Yang, Lei Wang, Shijie Zhou, Shilong Zhang, Yongfang Xu, Yujie Bian, Zhaowei Tian, Yusen Yang, Min Wei.  (2025)  Designing Cu0−Cu+ dual sites for reversible dehydrogenation and hydrogenation of N-heterocycles.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.166251]

Domande frequenti

What is the purity of this product?

This product is supplied at ≥96% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

How should this product be stored?

Store in a cool place, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 5263-87-6, the molecular formula is C10H9NO, and the molecular weight is 159.18 g/mol. InChIKey HFDLDPJYCIEXJP-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.