2-Iodo-3-hydroxypyridine - ≥98% , CAS No.40263-57-8

CAS: 40263-57-8 Cat. No.: I119977 Fórmula: C₅H₄INO Peso molecular: 221 Beilstein Registry Number: 109836 Número CE: 254-864-0

GRAU & PUREZA ≥98%

Synonyms

2-Iodo-3-pyridinol | HJBGMPCMSWJZNH-UHFFFAOYSA- | MB00322 | 3-Pyridinol, 2-iodo- | FT-0647107 | 2-Iodopyridin-3-ol | NSC103161 | NSC-103161 | 2(1H)-Quinolinone, 6-bromo- | BCP22989 | FT-0615803 | AKOS005258009 | EN300-101423 | 6-bromo-1,4-dihydroquinolin-

Storage

Room temperature

Shipped In

Normal

Especificações

Sinónimos

2-Iodo-3-pyridinol | HJBGMPCMSWJZNH-UHFFFAOYSA- | MB00322 | 3-Pyridinol, 2-iodo- | FT-0647107 | 2-Iodopyridin-3-ol | NSC103161 | NSC-103161 | 2(1H)-Quinolinone, 6-bromo- | BCP22989 | FT-0615803 | AKOS005258009 | EN300-101423 | 6-bromo-1,4-dihydroquinolin-

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

504756356

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504756356

Sorrisos canónicos

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

IUPAC Name

2-iodopyridin-3-ol

InChIKey

HJBGMPCMSWJZNH-UHFFFAOYSA-N

INCHI

1S/C5H4INO/c6-5-4(8)2-1-3-7-5/h1-3,8H

SMILES isoméricas

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

WGK Alemanha

3

Peso molecular

221

Beilstein

109836

Reaxy-Rn

109836

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109836&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Halopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: 2-halopyridines
• Alternative Parents: Hydroxypyridines Aryl iodides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organoiodides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-halopyridine - Hydroxypyridine - Aryl iodide - Aryl halide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as 2-halopyridines. These are organic compounds containing a pyridine ring substituted at the 2-position by a halogen atom.
• 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

Propriedades químicas e físicas

• Solubilidade: Soluble in Methanol
• Sensibilidade: Air Sensitive
• Ponto de fusão (°C): 191-195°C
• Peso molecular: 221.000 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 220.934 Da
• Monoisotopic Mass: 220.934 Da
• Topological Polar Surface Area: 33.100 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 78.800
• 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