3-Methylpyridine-2-carboxaldehyde - ≥98% , CAS No.55589-47-4

CAS: 55589-47-4 Cat. No.: M120655 Summenformel: C₇H₇NO Molekulargewicht: 121.14 EG-Nummer: 625-569-8

GRADE & PURITY ≥98%

Synonyms

3-methyl-2-pyridine Aldehyde | 3-Methylpyridine-2-carboxaldehyde, 97% | Pyridinecarboxaldehyde, methyl- | SY008466 | 2-Formyl-3-methylpyridine | 3-methyl-pyridine-2-carboxaldehyde | 3-METHYLPYRIDINE-2-CARBOXALDEHYDE | DTXSID40363545 | BB 0220500 | Z107944

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

3-methyl-2-pyridine Aldehyde | 3-Methylpyridine-2-carboxaldehyde, 97% | Pyridinecarboxaldehyde, methyl- | SY008466 | 2-Formyl-3-methylpyridine | 3-methyl-pyridine-2-carboxaldehyde | 3-METHYLPYRIDINE-2-CARBOXALDEHYDE | DTXSID40363545 | BB 0220500 | Z107944

Spezifikationen & Reinheit

≥98%

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

488191862

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488191862

Kanonisches Lächeln

CC1=C(N=CC=C1)C=O

IUPAC Name

3-methylpyridine-2-carbaldehyde

InChIKey

JDYVLWWFVYNMTN-UHFFFAOYSA-N

INCHI

1S/C7H7NO/c1-6-3-2-4-8-7(6)5-9/h2-5H,1H3

Isomere SMILES

CC1=C(N=CC=C1)C=O

WGK Deutschland

3

Molekulargewicht

121.14

Reaxy-Rn

107760

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=107760&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: Methylpyridines Aryl-aldehydes Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-pyridine carboxaldehyde - Methylpyridine - Aryl-aldehyde - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen 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
• Brechungsindex: n20/D 1.538
• Flammpunkt (°F): 163.4 °F
• Flammpunkt (°C): 73 °C(163.4 °F)
• Siedepunkt (°C): 84°C/13mmHg
• Schmelzpunkt (°C): 8°C
• Molekulargewicht: 121.140 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 121.053 Da
• Monoisotopic Mass: 121.053 Da
• Topological Polar Surface Area: 30.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 103.000
• 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 ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

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

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 55589-47-4, the molecular formula is C7H7NO, and the molecular weight is 121.14 g/mol. InChIKey JDYVLWWFVYNMTN-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.