Methyl (4-chloro-5-(4-methylphenyl)-3-oxo-2(3H)furanylidene)acetate

Base Information

• Chemical Name: Methyl (4-chloro-5-(4-methylphenyl)-3-oxo-2(3H)furanylidene)acetate
• CAS No.: 139266-41-4
• Molecular Formula: C₁₄H₁₁ClO₄
• Molecular Weight: 278.692
• NSC Number: 677935
• Wikidata: Q76309034
• ChEMBL ID: CHEMBL1979453
• Mol file: 139266-41-4.mol

Synonyms:Methyl (4-chloro-5-(4-methylphenyl)-3-oxo-2(3H)furanylidene)acetate;Acetic acid, (4-chloro-5-(4-methylphenyl)-3-oxo-2(3H)furanylidene)-, methyl ester;139266-41-4;NSC677935;CHEMBL1979453;NSC-677935

Chemical Property of Methyl (4-chloro-5-(4-methylphenyl)-3-oxo-2(3H)furanylidene)acetate

Chemical Property:

• Vapor Pressure: 3.42E-08mmHg at 25°C
• Boiling Point: 447.2°C at 760 mmHg
• Flash Point: 187.6°C
• Density: 1.35g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 278.0345865
• Heavy Atom Count: 19
• Complexity: 456

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C2=C(C(=O)C(=CC(=O)OC)O2)Cl
• Isomeric SMILES: CC1=CC=C(C=C1)C2=C(C(=O)/C(=C\C(=O)OC)/O2)Cl