1,8-Naphthyridine - ≥98%(GC) , CAS No.254-60-4

CAS: 254-60-4 Cat. No.: N133764 Formule: C₈H₆N₂ Poids moléculaire: 130.15 Beilstein Registry Number: 23(3/4)1237 Numéro CE: 675-799-8

QUALITÉ & PURETÉ ≥98%(GC)

Synonyms

DTXSID40180052 | NCGC00025349-02 | W3P | 1,8-Diazanapthalene | napy | 5-Cholesten-3B-ol | AM20070185 | SCHEMBL8193 | GS-3533 | FT-0631893 | SCHEMBL9559247 | Z1201618482 | 1,8-Diazanaphthalene | AC-9573 | N0464 | AKOS005146157 | EN300-94649 | naphthyridin

Storage

Room temperature,Argon charged

Shipped In

Normal

Spécifications

Synonymes

DTXSID40180052 | NCGC00025349-02 | W3P | 1,8-Diazanapthalene | napy | 5-Cholesten-3B-ol | AM20070185 | SCHEMBL8193 | GS-3533 | FT-0631893 | SCHEMBL9559247 | Z1201618482 | 1,8-Diazanaphthalene | AC-9573 | N0464 | AKOS005146157 | EN300-94649 | naphthyridin

Spécifications et pureté

≥98%(GC)

Conditions de stockage de stockage

Room temperature,Argon charged

Expédié en

Normal

Pureté

≥98%(GC)

Noms et identifiants

Pubchem Sid

528753504

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528753504

Sourires canoniques

C1=CC2=C(N=C1)N=CC=C2

IUPAC Name

1,8-naphthyridine

InChIKey

FLBAYUMRQUHISI-UHFFFAOYSA-N

INCHI

1S/C8H6N2/c1-3-7-4-2-6-10-8(7)9-5-1/h1-6H

Isomères SMILES

C1=CC2=C(N=C1)N=CC=C2

Poids moléculaire

130.15

Beilstein

23(3/4)1237

Reaxy-Rn

109347

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109347&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Diazanaphthalenes
      • Subclass Naphthyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Diazanaphthalenes
• Subclass: Naphthyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthyridines
• Alternative Parents: Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Naphthyridine - Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as naphthyridines. These are compounds containing a naphthyridine moiety, a naphthalene in which a carbon atom has been replaced by a nitrogen in each of the two rings. The naphthyridine skeleton can also be described as an assembly two fused pyridine rings, which do not share their nitrogen atom.
• External Descriptors: naphthyridine

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

Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Soluble in methanol, and water (slightly).
• Sensibilité: Moisture Sensitive
• Point de fusion (°C): 98 °C
• Poids moléculaire: 130.150 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 130.053 Da
• Monoisotopic Mass: 130.053 Da
• Topological Polar Surface Area: 25.800 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 102.000
• 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