5-Methoxypicolinaldehyd - ≥97% , CAS No.22187-96-8

CAS: 22187-96-8 Cat. No.: M182921 Summenformel: C₇H₇NO₂ Molekulargewicht: 137.1 EG-Nummer: 801-916-0

GRADE & PURITY ≥97%

Synonyms

PB17495 | 2-FORMYL-5-METHOXYPYRIDINE | AM84791 | Z1198176556 | DTXSID30634276 | 5-METHOXY-2-PYRIDINECARBOXALDEHYDE | SCHEMBL967531 | FT-0630178 | CTYUCLSCBVSTAA-UHFFFAOYSA-N | EN300-134886 | MFCD08234867 | SY039034 | 5-methoxy-pyridine-2-carbaldehyde | 5-

Storage

Lagerung bei 2-8°C, Argon geladen

Shipped In

Nasses Eis

Specifications

Synonyme

PB17495 | 2-FORMYL-5-METHOXYPYRIDINE | AM84791 | Z1198176556 | DTXSID30634276 | 5-METHOXY-2-PYRIDINECARBOXALDEHYDE | SCHEMBL967531 | FT-0630178 | CTYUCLSCBVSTAA-UHFFFAOYSA-N | EN300-134886 | MFCD08234867 | SY039034 | 5-methoxy-pyridine-2-carbaldehyde | 5-

Spezifikationen & Reinheit

≥97%

Storage

Lagerung bei 2-8°C, Argon geladen

Verschickt in

Nasses Eis

Reinheit

≥97%

Namen und Kennungen

• Pubchem Sid: 504769413
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504769413
• Kanonisches Lächeln: COC1=CN=C(C=C1)C=O
• IUPAC Name: 5-methoxypyridine-2-carbaldehyde
• InChIKey: CTYUCLSCBVSTAA-UHFFFAOYSA-N
• INCHI: 1S/C7H7NO2/c1-10-7-3-2-6(5-9)8-4-7/h2-5H,1H3
• Isomere SMILES: COC1=CN=C(C=C1)C=O
• Molekulargewicht: 137.1
• Reaxy-Rn: 1524450
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1524450&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Pyridines and derivatives
      • Subclass Pyridine carboxaldehydes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridines and derivatives
• Subclass: Pyridine carboxaldehydes
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridine carboxaldehydes
• Alternative Parents: Aryl-aldehydes Alkyl aryl ethers Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-pyridine carboxaldehyde - Aryl-aldehyde - Alkyl aryl ether - Heteroaromatic compound - Azacycle - Ether - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aldehyde - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as pyridine carboxaldehydes. These are aromatic compounds containing a pyridine ring which bears a carboxaldehyde group.
• 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Air sensitive
• Molekulargewicht: 137.140 g/mol
• XLogP3: 0.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 137.048 Da
• Monoisotopic Mass: 137.048 Da
• Topological Polar Surface Area: 39.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 116.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 22187-96-8, the molecular formula is C7H7NO2, and the molecular weight is 137.1 g/mol. InChIKey CTYUCLSCBVSTAA-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.