2,2′-Bipyridine-3,3′-diol - ≥98% , CAS No.36145-03-6

CAS: 36145-03-6 Cat. No.: B119887 Summenformel: C₁₀H₈N₂O₂ Molekulargewicht: 188.18 EG-Nummer: 632-215-6

GRADE & PURITY ≥98%

Synonyms

(2Z)-2-(3-Hydroxypyridin-2(1H)-ylidene)pyridin-3(2H)-one | YSWG799 | 2,2'-Bipyridine-3,3'-diol, 98% | 2-(3-HYDROXYPYRIDIN-2-YL)PYRIDIN-3-OL | MFCD00075177 | T70828 | [2,2'-bipyridyl]-3,3'-diol | 2,2'-bipyridyl-3,3'-diol | [2,2 inverted exclamation mark -B

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

(2Z)-2-(3-Hydroxypyridin-2(1H)-ylidene)pyridin-3(2H)-one | YSWG799 | 2,2'-Bipyridine-3,3'-diol, 98% | 2-(3-HYDROXYPYRIDIN-2-YL)PYRIDIN-3-OL | MFCD00075177 | T70828 | [2,2'-bipyridyl]-3,3'-diol | 2,2'-bipyridyl-3,3'-diol | [2,2 inverted exclamation mark -B

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

504759165

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504759165

Kanonisches Lächeln

C1=CC(=C(N=C1)C2=C(C=CC=N2)O)O

IUPAC Name

2-(3-hydroxypyridin-2-yl)pyridin-3-ol

InChIKey

RJNRKZBHLCOHNM-UHFFFAOYSA-N

INCHI

1S/C10H8N2O2/c13-7-3-1-5-11-9(7)10-8(14)4-2-6-12-10/h1-6,13-14H

Isomere SMILES

C1=CC(=C(N=C1)C2=C(C=CC=N2)O)O

WGK Deutschland

3

Molekulargewicht

188.18

Reaxy-Rn

781711

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=781711&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Pyridines and derivatives
      • Subclass Bipyridines and oligopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridines and derivatives
• Subclass: Bipyridines and oligopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Bipyridines and oligopyridines
• Alternative Parents: Hydroxypyridines Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Bipyridine - Hydroxypyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as bipyridines and oligopyridines. These are organic compounds containing two pyridine rings linked to each other.
• 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: Light Sensitive,Air Sensitive
• Schmelzpunkt (°C): 194-196°C
• Molekulargewicht: 188.180 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 188.059 Da
• Monoisotopic Mass: 188.059 Da
• Topological Polar Surface Area: 66.200 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 169.000
• 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