4-Chloro-2-hydroxypyridine - ≥98% , CAS No.40673-25-4

CAS: 40673-25-4 Cat. No.: C153941 Summenformel: C₅H₄ClNO Molekulargewicht: 129.54 EG-Nummer: 670-280-2

GRADE & PURITY ≥98%

Synonyms

2(1H)-Pyridinone, 4-chloro- | 4-Chloro-2-hydroxypyridine | 4-Chloro-2-hydroxy-pyridine | 4-chloropyridone | STL556801 | AM20051167 | A6794 | AKOS005199007 | 4-chloro-2-pyridone | C3120 | MFCD03093022 | DTXSID70373970 | SCHEMBL608199 | AC-6269 | 4-chloro-1

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

2(1H)-Pyridinone, 4-chloro- | 4-Chloro-2-hydroxypyridine | 4-Chloro-2-hydroxy-pyridine | 4-chloropyridone | STL556801 | AM20051167 | A6794 | AKOS005199007 | 4-chloro-2-pyridone | C3120 | MFCD03093022 | DTXSID70373970 | SCHEMBL608199 | AC-6269 | 4-chloro-1

Spezifikationen & Reinheit

≥98%

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 488193074
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488193074
• Kanonisches Lächeln: C1=CNC(=O)C=C1Cl
• IUPAC Name: 4-chloro-1H-pyridin-2-one
• InChIKey: OZUXGFRLSKQVMI-UHFFFAOYSA-N
• INCHI: 1S/C5H4ClNO/c6-4-1-2-7-5(8)3-4/h1-3H,(H,7,8)
• Isomere SMILES: C1=CNC(=O)C=C1Cl
• Molekulargewicht: 129.54
• Reaxy-Rn: 1524510
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1524510&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Pyridines and derivatives
      • Subclass Hydropyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridines and derivatives
• Subclass: Hydropyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinones
• Alternative Parents: Dihydropyridines Aryl chlorides Vinylogous halides Heteroaromatic compounds Lactams Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Dihydropyridine - Pyridinone - Aryl chloride - Aryl halide - Vinylogous halide - Heteroaromatic compound - Lactam - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as pyridinones. These are compounds containing a pyridine ring, which bears a ketone.
• 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
• Schmelzpunkt (°C): 177-179°C
• Molekulargewicht: 129.539 g/mol
• XLogP3: 0.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 128.998 Da
• Monoisotopic Mass: 128.998 Da
• Topological Polar Surface Area: 29.100 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 171.000
• 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 40673-25-4, the molecular formula is C5H4ClNO, and the molecular weight is 129.54 g/mol. InChIKey OZUXGFRLSKQVMI-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.