Imidazo[1,2-b]pyridazine - ≥98% , CAS No.766-55-2

CAS: 766-55-2 Cat. No.: I124056 Molecular Weight: 119.13 EC Number: 806-512-8

GRADE & PURITY ≥98%

Synonyms

Imidazo(1,2-b)pyridazine | Q-100820 | Z1741971885 | I0742 | HSDB 3290 | VTVRXITWWZGKHV-UHFFFAOYSA-N | DTXSID10227408 | Methanone,[2-(1,1-dimethylethyl)imidazo[1,2-b]pyridazin-6-yl]phenyl- | Imidazol[1,2-b]pyridazine | SY008983 | Imidazo[1,2-b]pyridazine,m

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Imidazo(1, 2-b)pyridazine | Q-100820 | Z1741971885 | I0742 | HSDB 3290 | VTVRXITWWZGKHV-UHFFFAOYSA-N | DTXSID10227408 | Methanone, [2-(1, 1-dimethylethyl)imidazo[1, 2-b]pyridazin-6-yl]phenyl- | Imidazol[1, 2-b]pyridazine | SY008983 | Imidazo[1, 2-b]pyridazine, m

Specifications & Purity

≥98%

Storage

Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488187886
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488187886
• Canonical Smiles: C1=CC2=NC=CN2N=C1
• IUPAC Name: imidazo[1,2-b]pyridazine
• InChIKey: VTVRXITWWZGKHV-UHFFFAOYSA-N
• INCHI: 1S/C6H5N3/c1-2-6-7-4-5-9(6)8-3-1/h1-5H
• Isomeric SMILES: C1=CC2=NC=CN2N=C1
• Molecular Weight: 119.13
• Reaxy-Rn: 606561
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=606561&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Diazines
      • Subclass Pyridazines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Diazines
• Subclass: Pyridazines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridazines and derivatives
• Alternative Parents: N-substituted imidazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pyridazine - N-substituted imidazole - Heteroaromatic compound - Imidazole - Azole - 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 pyridazines and derivatives. These are compounds containing a pyridazine ring, which is a six-member aromatic ring containing two nitrogen atoms at positions 1 and 2, and four carbon atoms.
• 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

Chemical and Physical Properties

• Solubility: Soluble in Dimethylformamide
• Sensitivity: Hygroscopic
• Melt Point(°C): 54°C
• Molecular Weight: 119.120 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 119.048 Da
• Monoisotopic Mass: 119.048 Da
• Topological Polar Surface Area: 30.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 104.000
• 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

References

1. Xingxing Gu, Yixun Du, Xiaolei Ren, Fengcan Ma, Xianfu Zhang, Meng Li, Qinghong Wang, Long Zhang, Chao Lai, Shanqing Zhang.  (2024)  Shielding-Anchoring Double Protection Tactics of Imidazo[1,2-b]pyridazine Additive for Ultrastable Zinc Anode.  ADVANCED FUNCTIONAL MATERIALS,      [PMID:] [10.1002/adfm.202316541]