2-Methylpyridine N-Oxide - ≥99%(GC) , CAS No.931-19-1

CAS: 931-19-1 Cat. No.: M158853 Formula: C₆H₇NO Peso molecolare: 109.13 Beilstein Registry Number: 106916 Numero EC: 213-230-3

GRADE & PURITY ≥99%(GC)

Synonyms

2-Methylpyridine N-oxide | CFZKDDTWZYUZKS-UHFFFAOYSA-N | CHEBI:35578 | Pyridine, methyl-, 1-oxide | 2-Methylpyridine N-oxide, >=96% | 2-picoline-1-oxide | Q27116520 | F0001-2244 | W-100254 | 2-methyl-pyridine-N-oxide | 2-methylpyridine-N-oxide | AI3-24502

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinonimi

2-Methylpyridine N-oxide | CFZKDDTWZYUZKS-UHFFFAOYSA-N | CHEBI:35578 | Pyridine, methyl-, 1-oxide | 2-Methylpyridine N-oxide, >=96% | 2-picoline-1-oxide | Q27116520 | F0001-2244 | W-100254 | 2-methyl-pyridine-N-oxide | 2-methylpyridine-N-oxide | AI3-24502

Specifiche e purezza

≥99%(GC)

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normal

Purezza

≥99%(GC)

Nomi e identificatori

Sorrisi canonici

CC1=CC=CC=[N+]1[O-]

IUPAC Name

2-methyl-1-oxidopyridin-1-ium

InChIKey

CFZKDDTWZYUZKS-UHFFFAOYSA-N

INCHI

1S/C6H7NO/c1-6-4-2-3-5-7(6)8/h2-5H,1H3

Isomeri SMILES

CC1=CC=CC=[N+]1[O-]

WGK Germania

3

Peso molecolare

109.13

Beilstein

106916

Reaxy-Rn

106916

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=106916&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives
      • Subclass Methylpyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Methylpyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Methylpyridines
• Alternative Parents: Pyridinium derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Methylpyridine - Pyridinium - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as methylpyridines. These are organic compounds containing a pyridine ring substituted at one or more positions by a methyl group.
• External Descriptors: a small molecule

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

• Solubilità: Soluble in water.
• Sensibilità: Moisture sensitive
• Punto di infiammabilità (°F): 289.4 °F
• Punto di infiammabilità (°C): 143 °C
• Punto di ebollizione (°C): 261 °C
• Punto di fusione (°C): 48 °C
• Peso molecolare: 109.130 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 109.053 Da
• Monoisotopic Mass: 109.053 Da
• Topological Polar Surface Area: 25.500 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 74.900
• 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