2-Cyano-3-hydroxypyridine - ≥98%(GC) , CAS No.932-35-4

CAS: 932-35-4 Cat. No.: C139454 Formula: C₆H₄N₂O Peso molecolare: 120.11 Beilstein Registry Number: 22(5)5,90 Numero EC: 213-251-8

GRADE & PURITY ≥98%(GC)

Synonyms

O11015 | 3-Hydroxy-2-pyridinecarbonitrile, AldrichCPR | KBio2_003307 | 2-cyano-3-pyridinol | SY031451 | PS-5915 | 3-hydroxy-pyridine-2-carbonitrile | 3-Hydroxypyridine-2-carbonitrile | XTVFTOVNAKNVQK-UHFFFAOYSA- | FT-0649637 | PB43869 | BCP04199 | 3-Hydro

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

O11015 | 3-Hydroxy-2-pyridinecarbonitrile, AldrichCPR | KBio2_003307 | 2-cyano-3-pyridinol | SY031451 | PS-5915 | 3-hydroxy-pyridine-2-carbonitrile | 3-Hydroxypyridine-2-carbonitrile | XTVFTOVNAKNVQK-UHFFFAOYSA- | FT-0649637 | PB43869 | BCP04199 | 3-Hydro

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥98%(GC)

Nomi e identificatori

Pubchem Sid

488187282

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488187282

Sorrisi canonici

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

IUPAC Name

3-hydroxypyridine-2-carbonitrile

InChIKey

XTVFTOVNAKNVQK-UHFFFAOYSA-N

INCHI

1S/C6H4N2O/c7-4-5-6(9)2-1-3-8-5/h1-3,9H

Isomeri SMILES

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

Peso molecolare

120.11

Beilstein

22(5)5,90

Reaxy-Rn

472033

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=472033&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Hydroxypyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Hydroxypyridines
• Alternative Parents: Heteroaromatic compounds Nitriles Azacyclic compounds Organopnictogen compounds Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Hydroxypyridine - Heteroaromatic compound - Azacycle - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as hydroxypyridines. These are organic compounds containing a pyridine ring substituted at one or more positions by a hydroxyl 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

Proprietà chimiche e fisiche

• Solubilità: Soluble in Methanol
• Peso molecolare: 120.110 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 120.032 Da
• Monoisotopic Mass: 120.032 Da
• Topological Polar Surface Area: 56.900 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 137.000
• 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

Domande frequenti

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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 932-35-4, the molecular formula is C6H4N2O, and the molecular weight is 120.11 g/mol. InChIKey XTVFTOVNAKNVQK-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.