Ambcb5894724

Base Information

• Chemical Name: Ambcb5894724
• CAS No.: 5894-72-4
• Molecular Formula: C21H17BrFNO4
• Molecular Weight: 446.2664
• DSSTox Substance ID: DTXSID50366981
• Wikidata: Q82152513

Synonyms:5894-72-4;Ambcb5894724;DTXSID50366981;AKOS003820956;4-[4-(allyloxy)-3-bromo-5-ethoxybenzylidene]-2-(3-fluorophenyl)-1,3-oxazol-5(4H)-one

Chemical Property of Ambcb5894724

Chemical Property:

• Vapor Pressure: 2.26E-11mmHg at 25°C
• Boiling Point: 531.3°Cat760mmHg
• Flash Point: 275.1°C
• Density: 1.39g/cm³
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 445.03250
• Heavy Atom Count: 28
• Complexity: 638

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)F)Br)OCC=C
• Isomeric SMILES: CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)OC(=N2)C3=CC(=CC=C3)F)Br)OCC=C

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