Methyl 2-(2-(phenylthio)-5-propionylphenyl)acetate

Base Information

• Chemical Name: Methyl 2-(2-(phenylthio)-5-propionylphenyl)acetate
• CAS No.: 108051-48-5
• Molecular Formula: C18H18 O3 S
• Molecular Weight: 314.4
• DSSTox Substance ID: DTXSID10558406
• Nikkaji Number: J404.129A
• Wikidata: Q72499115
• Mol file: 108051-48-5.mol

Synonyms:108051-48-5;methyl 2-(2-(phenylthio)-5-propionylphenyl)acetate;Benzeneacetic acid,5-(1-oxopropyl)-2-(phenylthio)-, methyl ester;methyl 2-(2-phenylsulfanyl-5-propanoylphenyl)acetate;SCHEMBL7030014;DTXSID10558406;JXZVVGJNQWQZOY-UHFFFAOYSA-N;methyl 2-phenylthio-5-propionylphenylacetate;methyl 5-propionyl-2-phenylthiophenylacetate;Methyl [2-(phenylsulfanyl)-5-propanoylphenyl]acetate

Chemical Property of Methyl 2-(2-(phenylthio)-5-propionylphenyl)acetate

Chemical Property:

• Boiling Point: 457.2±45.0 °C(Predicted)
• PSA: 68.67000
• Density: 1.20
• LogP: 4.14600
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 314.09766561
• Heavy Atom Count: 22
• Complexity: 377

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2)CC(=O)OC