(2-Methyl-6-quinolinyl)methanol - ≥98% , CAS No.108166-02-5

CAS: 108166-02-5 Cat. No.: M189603 Formula: C₁₁H₁₁NO Peso molecolare: 173.21 Numero EC: 687-719-9

GRADE & PURITY ≥95%

Synonyms

6-Hydroxymethyl-2-methylquinoline | (2-Methyl-6-quinolinyl)methanol | A895351 | 2-Methylquinoline-6-methanol | HLFYJILNIBADGG-UHFFFAOYSA-N | SY023406 | 6-(Hydroxymethyl)-2-methylquinoline | FT-0694797 | MFCD06659066 | AKOS006345478 | (2-Methyl-6-quinoliny

Storage

Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Panoramica

2-Methylquinoline-6-methanol is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. (2-Methyl-6-quinolinyl)methanol provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.

Specifications

Sinonimi

6-Hydroxymethyl-2-methylquinoline | (2-Methyl-6-quinolinyl)methanol | A895351 | 2-Methylquinoline-6-methanol | HLFYJILNIBADGG-UHFFFAOYSA-N | SY023406 | 6-(Hydroxymethyl)-2-methylquinoline | FT-0694797 | MFCD06659066 | AKOS006345478 | (2-Methyl-6-quinoliny

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Store at -20°C,Desiccated

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥95%

Nomi e identificatori

• Sorrisi canonici: CC1=NC2=C(C=C1)C=C(C=C2)CO
• IUPAC Name: (2-methylquinolin-6-yl)methanol
• InChIKey: HLFYJILNIBADGG-UHFFFAOYSA-N
• INCHI: 1S/C11H11NO/c1-8-2-4-10-6-9(7-13)3-5-11(10)12-8/h2-6,13H,7H2,1H3
• Isomeri SMILES: CC1=NC2=C(C=C1)C=C(C=C2)CO
• Peso molecolare: 173.21
• Reaxy-Rn: 8200050
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8200050&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: Methylpyridines Benzenoids Heteroaromatic compounds Azacyclic compounds Primary alcohols Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinoline - Methylpyridine - Pyridine - Benzenoid - Heteroaromatic compound - Azacycle - Hydrocarbon derivative - Aromatic alcohol - Organic nitrogen compound - Alcohol - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organopnictogen 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: 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

Proprietà chimiche e fisiche

• Peso molecolare: 173.210 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 173.084 Da
• Monoisotopic Mass: 173.084 Da
• Topological Polar Surface Area: 33.100 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 171.000
• 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