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

CAS: 91-62-3 Cat. No.: M109545 Summenformel: C₁₀H₉N Molekulargewicht: 143.19 Beilstein Registry Number: 110336 EG-Nummer: 202-084-6

GRADE & PURITY ≥98%

Synonyms

6-Methylquinolin, >=98%, FG | p-Toluquinolin | NCGC00091226-02 | p-Tolliquinolin | AI3-08869 | HMS3039C14 | Quinolin, 6-methyl- | MLS002303009 | Quinolin, 6-methyl- (8CI,9CI) | Tox21_300320 | CCRIS 407 | EINECS 202-084-6 | NCGC00091226-03 | FEMA 2744

Storage

Protected from light,Argon charged,Room temperature

Shipped In

FedEx DG Service

Specifications

Synonyme

6-Methylquinolin, >=98%, FG | p-Toluquinolin | NCGC00091226-02 | p-Tolliquinolin | AI3-08869 | HMS3039C14 | Quinolin, 6-methyl- | MLS002303009 | Quinolin, 6-methyl- (8CI,9CI) | Tox21_300320 | CCRIS 407 | EINECS 202-084-6 | NCGC00091226-03 | FEMA 2744

Spezifikationen & Reinheit

≥98%

Biochemische und physiologische Mechanismen

6-Methylchinolin wird von einer chinolinabbauenden Kultur von Pseudomonas putida biologisch abgebaut.

Storage

Protected from light,Argon charged,Room temperature

Verschickt in

FedEx DG Service

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 488180267
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488180267
• Kanonisches Lächeln: 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
• Isomere SMILES: CC1=CC2=C(C=C1)N=CC=C2
• WGK Deutschland: 3
• RTECS: AI5950000
• Molekulargewicht: 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
    • Klasse Quinolines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: 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
• Beschreibung: 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

Zugehörige Ziele (menschlich)

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

Zugehörige Ziele (nicht menschlich)

Plasmodium falciparum (966862 Activities)

Explore this target

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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Not miscible or difficult to mix with water.
• Empfindlichkeit: Air & Light Sensitive
• Brechungsindex: 1.615～1.616
• Flammpunkt (°F): 235.4 °F
• Flammpunkt (°C): 113 °C
• Siedepunkt (°C): 259°C
• Schmelzpunkt (°C): 22°C
• Molekulargewicht: 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

Referenzen

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]

Häufig gestellte Fragen

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.