2,5-Cyclohexadiene-1,4-dione, 2-(1-aziridinyl)-

Base Information

• Chemical Name: 2,5-Cyclohexadiene-1,4-dione, 2-(1-aziridinyl)-
• CAS No.: 4370-53-0
• Molecular Formula: C8H7NO2
• Molecular Weight: 149.14700
• DSSTox Substance ID: DTXSID40468968
• Wikidata: Q82296498
• Mol file: 4370-53-0.mol

Synonyms:2,5-Cyclohexadiene-1,4-dione, 2-(1-aziridinyl)-;4370-53-0;SCHEMBL1420707;DTXSID40468968

Chemical Property of 2,5-Cyclohexadiene-1,4-dione, 2-(1-aziridinyl)-

Chemical Property:

• Boiling Point: 263.5±35.0 °C(Predicted)
• PSA: 37.15000
• Density: 1.462±0.06 g/cm3(Predicted)
• LogP: -0.16820
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 149.047678466
• Heavy Atom Count: 11
• Complexity: 285

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN1C2=CC(=O)C=CC2=O