1H-Imidazo[4,5-d]pyridazine

Base Information

• Chemical Name: 1H-Imidazo[4,5-d]pyridazine
• CAS No.: 273-00-7
• Molecular Formula: C5H4 N4
• Molecular Weight: 120.11
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID40418680,DTXSID801310323
• Nikkaji Number: J517.878I
• Wikidata: Q82229305
• ChEMBL ID: CHEMBL3144350
• Mol file: 273-00-7.mol

Synonyms:1H-Imidazo[4,5-d]pyridazine;273-00-7;imidazo[4,5-d]pyridazine;1H-Imidazo(4,5-d)pyridazine;5h-imidazo[4,5-d]pyridazine;SCHEMBL1220594;SCHEMBL1325149;CHEMBL3144350;DTXSID40418680;DTXSID801310323;AKOS006307701;34392-27-3

Chemical Property of 1H-Imidazo[4,5-d]pyridazine

Chemical Property:

• Boiling Point: 589.2±23.0 °C(Predicted)
• PKA: 9.70±0.70(Predicted)
• PSA: 54.46000
• Density: 1.472±0.06 g/cm3(Predicted)
• LogP: 0.35290
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 120.043596145
• Heavy Atom Count: 9
• Complexity: 105

Purity/Quality:

95% purity ^*data from raw suppliers

1H-Imidazo[4,5-d]pyridazine 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C2C(=CN=N1)N=CN2