2,3-Diaminopyridine - ≥96% , CAS No.452-58-4

CAS: 452-58-4 Cat. No.: D103174 Fórmula: C₅H₇N₃ Peso molecular: 109.13 Beilstein Registry Number: 109869 Número CE: 207-200-9

GRADE & PURITY ≥96%

Synonyms

pyridine-2,3-diamine

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Visão geral

2,3-Diaminopyridine forms the bis-condensed Schiff base with salicylaldehyde. It forms charge transfer complex with tetrachloro-p-benzoquinone and tetracyanoethylene

Specifications

Sinónimos

pyridine-2,3-diamine

Especificações e pureza

≥96%

Condições de armazenamento de armazenamento

Protected from light,Room temperature,Argon charged

Enviado em

Normal

Pureza

≥96%

Nomes e identificadores

Pubchem Sid

488181056

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181056

Sorrisos canónicos

C1=CC(=C(N=C1)N)N

IUPAC Name

pyridine-2,3-diamine

InChIKey

ZZYXNRREDYWPLN-UHFFFAOYSA-N

INCHI

1S/C5H7N3/c6-4-2-1-3-8-5(4)7/h1-3H,6H2,(H2,7,8)

SMILES isoméricas

C1=CC(=C(N=C1)N)N

WGK Alemanha

3

RTECS

US7548000

Número UN

2811

Peso molecular

109.13

Beilstein

109869

Reaxy-Rn

109869

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109869&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Aminopyridines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminopyridines and derivatives
• Alternative Parents: Imidolactams Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aminopyridine - Imidolactam - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as aminopyridines and derivatives. These are organic heterocyclic compounds containing an amino group attached to a pyridine ring.
• 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: Solubility in Water almost transparency; solubility in H2O: soluble 50 mg/mL, opaque (brown to very dark brown)
• Sensibilidade: Air sensitive；Light sensitive
• Ponto de inflamação (°F): 401°F
• Ponto de inflamação (°C): 205℃
• Ponto de fusão (°C): 112°C-118°C
• Peso molecular: 109.130 g/mol
• XLogP3: -0.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 109.064 Da
• Monoisotopic Mass: 109.064 Da
• Topological Polar Surface Area: 64.900 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 74.100
• 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