4-(6-Chloro-benzo[1,3]dioxol-5-ylmethylene)-2-phenyl-4H-oxazol-5-one

Base Information

• Chemical Name: 4-(6-Chloro-benzo[1,3]dioxol-5-ylmethylene)-2-phenyl-4H-oxazol-5-one
• CAS No.: 6641-76-5
• Molecular Formula: C17H10 Cl N O4
• Molecular Weight: 327.72
• NSC Number: 17948
• Mol file: 6641-76-5.mol

Synonyms:6641-76-5;4-(6-Chloro-benzo[1,3]dioxol-5-ylmethylene)-2-phenyl-4H-oxazol-5-one;(4Z)-4-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-2-phenyl-1,3-oxazol-5-one;4-((6-Chlorobenzo[d][1,3]dioxol-5-yl)methylene)-2-phenyloxazol-5(4H)-one;NSC17948;NSC-17948;AKOS000516123;SR-01000413223;SR-01000413223-1

Chemical Property of 4-(6-Chloro-benzo[1,3]dioxol-5-ylmethylene)-2-phenyl-4H-oxazol-5-one

Chemical Property:

• Vapor Pressure: 3.76E-09mmHg at 25°C
• Boiling Point: 474°C at 760 mmHg
• Flash Point: 240.4°C
• PSA: 57.12000
• Density: 1.46g/cm³
• LogP: 2.84880
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 327.0298355
• Heavy Atom Count: 23
• Complexity: 541

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1OC2=C(O1)C=C(C(=C2)C=C3C(=O)OC(=N3)C4=CC=CC=C4)Cl
• Isomeric SMILES: C1OC2=C(O1)C=C(C(=C2)/C=C\3/C(=O)OC(=N3)C4=CC=CC=C4)Cl

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