6-Methylpyridine-2-carboxaldehyde - ≥98% , CAS No.1122-72-1

CAS: 1122-72-1 Cat. No.: M101568 Peso molecular: 121.14 Beilstein Registry Number: 107476 Número EC: 214-359-8

GRADE & PURITY ≥98%

Synonyms

6-Methyl pyridine-2-aldehyde | 6-methyl,2-pyridinecarboxaldehyde | 6-Methyl-2-picolinaldehyde | Phosphorsaeure | AC-5120 | SY007849 | 2-Pyridinecarboxaldehyde, 6-methyl- | BCP22317 | 6-Methylpicolinaldehyde | NSC 8954 | Z1079442396 | Phenyl pyruvic acid |

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

6-Methyl pyridine-2-aldehyde | 6-methyl, 2-pyridinecarboxaldehyde | 6-Methyl-2-picolinaldehyde | Phosphorsaeure | AC-5120 | SY007849 | 2-Pyridinecarboxaldehyde, 6-methyl- | BCP22317 | 6-Methylpicolinaldehyde | NSC 8954 | Z1079442396 | Phenyl pyruvic acid |

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

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Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504754565
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754565
• Sonrisas canónicas: CC1=NC(=CC=C1)C=O
• IUPAC Name: 6-methylpyridine-2-carbaldehyde
• InChIKey: AHISYUZBWDSPQL-UHFFFAOYSA-N
• INCHI: 1S/C7H7NO/c1-6-3-2-4-7(5-9)8-6/h2-5H,1H3
• Isómeros SMILES: CC1=NC(=CC=C1)C=O
• WGK Alemania: 3
• Peso molecular: 121.14
• Beilstein: 107476
• Reaxy-Rn: 107476
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=107476&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: 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
• Descripción: 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

Propiedades químicas y físicas

• Solubilidad: Soluble in water (750 g/L).
• Sensibilidad: Light Sensitive/Air Sensitive
• Punto de congelación (°C): 30 °C
• Índice de refracción: 1.527
• Punto de inflamación (°F): 154.4 °F
• Punto de inflamación (°C): 68 °C
• Punto de fusión (°C): 31-33°C
• Peso molecular: 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

Referencias

1. Na Zhang, Yuying Li, Liduo Chen, Cuiqin Li, Guoliang Mao, Jun Wang.  (2021)  Synthesis, characterization, and ethylene oligomerization with star iminopyridine nickel(II) complexes.  JOURNAL OF COORDINATION CHEMISTRY,      [PMID:] [10.1080/00958972.2021.1888374]

2. Conghao Liu, Yang Yang, Runzhi Li, Xiaoqing Zhang, Dionisio Zaldivar Silva, Yuefeng Zhao, Ruizhuo Ouyang, Yuqing Miao, Baolin Liu, Shuang Zhou.  (2025)  Enhanced Anticancer Activity of Novel Bi (III)-Thiosemicarbazone Complexes Against Lung Cancer.  APPLIED ORGANOMETALLIC CHEMISTRY,  39  (7): (e70249).  [PMID:] [10.1002/aoc.70249]