6-Methylquinoline - ≥98% , CAS No.91-62-3

CAS: 91-62-3 Cat. No.: M109545 Fórmula: C₁₀H₉N Peso molecular: 143.19 Beilstein Registry Number: 110336 Número EC: 202-084-6

GRADE & PURITY ≥98%

Synonyms

6-Methylquinoline, >=98%, FG | p-Toluquinoline | NCGC00091226-02 | p-Tolliquinoline | AI3-08869 | HMS3039C14 | Quinoline, 6-methyl- | MLS002303009 | Quinoline, 6-methyl- (8CI,9CI) | Tox21_300320 | CCRIS 407 | EINECS 202-084-6 | NCGC00091226-03 | FEMA 2744

Storage

Protected from light,Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifications

Sinónimos

6-Methylquinoline, >=98%, FG | p-Toluquinoline | NCGC00091226-02 | p-Tolliquinoline | AI3-08869 | HMS3039C14 | Quinoline, 6-methyl- | MLS002303009 | Quinoline, 6-methyl- (8CI,9CI) | Tox21_300320 | CCRIS 407 | EINECS 202-084-6 | NCGC00091226-03 | FEMA 2744

Especificaciones y pureza

≥98%

Mecanismos bioquímicos y fisiológicos

6-Methylquinoline undergoes biodegradation by quinoline-degrading culture of Pseudomonas putida.

Condiciones de almacenamiento de almacenamiento

Protected from light,Room temperature,Argon charged

Enviado en

FedEx DG Service

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488180267
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488180267
• Sonrisas canónicas: CC1=CC2=C(C=C1)N=CC=C2
• IUPAC Name: 6-methylquinoline
• InChIKey: LUYISICIYVKBTA-UHFFFAOYSA-N
• INCHI: 1S/C10H9N/c1-8-4-5-10-9(7-8)3-2-6-11-10/h2-7H,1H3
• Isómeros SMILES: CC1=CC2=C(C=C1)N=CC=C2
• WGK Alemania: 3
• RTECS: AI5950000
• Peso molecular: 143.19
• Beilstein: 110336
• Reaxy-Rn: 110336
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=110336&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Quinolines and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinolines and derivatives
• Alternative Parents: Pyridines and derivatives Benzenoids Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinoline - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descripción: 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: Not available

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

Objetivos asociados (humanos)

ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

Discover Target: ALDH1A1

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

GMNN Tbio Geminin (128009 Activities)

Discover Target: GMNN

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

CBX1 Tbio Chromobox protein homolog 1 (92434 Activities)

Discover Target: CBX1

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

Objetivos asociados (no humanos)

Plasmodium falciparum (966862 Activities)

Explore this target

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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Not miscible or difficult to mix with water.
• Sensibilidad: Air & Light Sensitive
• Índice de refracción: 1.615～1.616
• Punto de inflamación (°F): 235.4 °F
• Punto de inflamación (°C): 113 °C
• Punto de ebullición (°C): 259°C
• Punto de fusión (°C): 22°C
• Peso molecular: 143.180 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 143.073 Da
• Monoisotopic Mass: 143.073 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 133.000
• 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

Referencias

1. Yufen Wang, Yantao Wang, Yongqing Ma, Asma Mohmmad Elsharif, Chen Zhang, Weiran Yang, Christophe Len.  (2024)  A transition-metal-free catalytic reduction of benzylic alcohols and alkenes and N-formylation of nitroarenes mediated by iodide ions and formic acid.  NEW JOURNAL OF CHEMISTRY,      [PMID:] [10.1039/D4NJ03772C]

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

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

The CAS Number is 91-62-3, the molecular formula is C10H9N, and the molecular weight is 143.19 g/mol. InChIKey LUYISICIYVKBTA-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.