2,4,4a,5,6,7-Hexahydro-3H-cyclopenta[c]pyridazin-3-one

Base Information

• Chemical Name: 2,4,4a,5,6,7-Hexahydro-3H-cyclopenta[c]pyridazin-3-one
• CAS No.: 94767-50-7
• Molecular Formula: C7H10N2O
• Molecular Weight: 138.16700
• DSSTox Substance ID: DTXSID40535422
• Nikkaji Number: J795.618E
• Mol file: 94767-50-7.mol

Synonyms:94767-50-7;2,4,4a,5,6,7-Hexahydro-3H-cyclopenta[c]pyridazin-3-one;SCHEMBL23792897;DTXSID40535422

Chemical Property of 2,4,4a,5,6,7-Hexahydro-3H-cyclopenta[c]pyridazin-3-one

Chemical Property:

• PSA: 44.95000
• LogP: 0.37390
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 138.079312947
• Heavy Atom Count: 10
• Complexity: 198

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2CC(=O)NN=C2C1