3-[2-(4-Fluorophenyl)-2-oxoethyl]-3,4-dihydroquinazolin-4-one

Base Information

• Chemical Name: 3-[2-(4-Fluorophenyl)-2-oxoethyl]-3,4-dihydroquinazolin-4-one
• CAS No.: 90059-69-1
• Molecular Formula: C16H11FN2O2
• Molecular Weight: 282.26900
• DSSTox Substance ID: DTXSID00350198
• Wikidata: Q82126011
• Mol file: 90059-69-1.mol

Synonyms:90059-69-1;3-(2-(4-Fluorophenyl)-2-oxoethyl)quinazolin-4(3H)-one;ST054316;3-[2-(4-fluorophenyl)-2-oxoethyl]-3,4-dihydroquinazolin-4-one;SCHEMBL14478800;DTXSID00350198;AKOS001299981;Z87553059;3-[2-(4-fluorophenyl)-2-oxoethyl]-4(3H)-quinazolinone

Chemical Property of 3-[2-(4-Fluorophenyl)-2-oxoethyl]-3,4-dihydroquinazolin-4-one

Chemical Property:

• Melting Point: 214-215 °C(Solv: methanol (67-56-1))
• Boiling Point: 482.2±51.0 °C(Predicted)
• PSA: 51.96000
• Density: 1.29±0.1 g/cm3(Predicted)
• LogP: 2.41850
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 282.08045576
• Heavy Atom Count: 21
• Complexity: 444

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)C3=CC=C(C=C3)F