2-Chloro-4-iodopyridine-3-carboxaldehyde - ≥98% , CAS No.153034-90-3

CAS: 153034-90-3 Cat. No.: C120649 Peso molecular: 267.45 Número EC: 640-125-3

GRADE & PURITY ≥98%

Synonyms

BCP12502 | PS-7307 | STL557223 | 2-CHLORO-4-IODO-3-PYRIDINECARBOXALDEHYDE | 2-Chloro-4-iodopyridine-3-carboxaldehyde, 97% | 2-Chloro-3-formyl-4-iodopyridine | Q-103363 | 2-Chloro-4-iodonicotinaldehyde | GEO-02628 | BBL103413 | FT-0651235 | DTXSID10434610

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

BCP12502 | PS-7307 | STL557223 | 2-CHLORO-4-IODO-3-PYRIDINECARBOXALDEHYDE | 2-Chloro-4-iodopyridine-3-carboxaldehyde, 97% | 2-Chloro-3-formyl-4-iodopyridine | Q-103363 | 2-Chloro-4-iodonicotinaldehyde | GEO-02628 | BBL103413 | FT-0651235 | DTXSID10434610

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488196508
• Sonrisas canónicas: C1=CN=C(C(=C1I)C=O)Cl
• IUPAC Name: 2-chloro-4-iodopyridine-3-carbaldehyde
• InChIKey: OPZCXONVRBYGHX-UHFFFAOYSA-N
• INCHI: 1S/C6H3ClINO/c7-6-4(3-10)5(8)1-2-9-6/h1-3H
• Isómeros SMILES: C1=CN=C(C(=C1I)C=O)Cl
• WGK Alemania: 3
• Peso molecular: 267.45
• Reaxy-Rn: 6643819
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6643819&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: Polyhalopyridines Aryl-aldehydes 2-halopyridines Aryl iodides Aryl chlorides Vinylogous halides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organoiodides Organochlorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 3-pyridine carboxaldehyde - Polyhalopyridine - 2-halopyridine - Aryl-aldehyde - Aryl chloride - Aryl halide - Aryl iodide - Heteroaromatic compound - Vinylogous halide - Azacycle - Aldehyde - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organoiodide - Organochloride - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - 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

• Sensibilidad: Air & Light Sensitive
• Punto de fusión (°C): 87-92°C
• Peso molecular: 267.450 g/mol
• XLogP3: 1.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 266.895 Da
• Monoisotopic Mass: 266.895 Da
• Topological Polar Surface Area: 30.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 133.000
• 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