4-(o-Chlorobenzylidene)-2-methyloxazol-5(4H)-one

Base Information

• Chemical Name: 4-(o-Chlorobenzylidene)-2-methyloxazol-5(4H)-one
• CAS No.: 32997-15-2
• Molecular Formula: C11H8ClNO2
• Molecular Weight: 221.6397
• NSC Number: 168627
• Mol file: 32997-15-2.mol

Synonyms:32997-15-2;4-(o-Chlorobenzylidene)-2-methyloxazol-5(4H)-one;NSC168627;CCG-253949;NSC-168627

Chemical Property of 4-(o-Chlorobenzylidene)-2-methyloxazol-5(4H)-one

Chemical Property:

• Vapor Pressure: 0.000195mmHg at 25°C
• Boiling Point: 328°Cat760mmHg
• PKA: 0.77±0.20(Predicted)
• Flash Point: 152.2°C
• PSA: 38.66000
• Density: 1.3g/cm³
• LogP: 2.09170
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 221.0243562
• Heavy Atom Count: 15
• Complexity: 336

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC(=CC2=CC=CC=C2Cl)C(=O)O1
• Isomeric SMILES: CC1=N/C(=C/C2=CC=CC=C2Cl)/C(=O)O1

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