Ethyl 3-[(4-fluorophenyl)thio]propanoate

Base Information

• Chemical Name: Ethyl 3-[(4-fluorophenyl)thio]propanoate
• CAS No.: 57247-34-4
• Molecular Formula: C11H13FO2S
• Molecular Weight: 228.28
• Hs Code.: 2916399090
• DSSTox Substance ID: DTXSID80381829
• Wikidata: Q82172927
• Mol file: 57247-34-4.mol

Synonyms:ethyl 3-[(4-fluorophenyl)thio]propanoate;57247-34-4;ethyl 3-(4-fluorophenyl)sulfanylpropanoate;ethyl 3-(4-fluorophenylthio)propanoate;DTXSID80381829;AKOS008950584

Chemical Property of Ethyl 3-[(4-fluorophenyl)thio]propanoate

Chemical Property:

• Boiling Point: 309.2±27.0 °C(Predicted)
• PSA: 51.60000
• Density: 1.17±0.1 g/cm3(Predicted)
• LogP: 2.87100
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 228.06202899
• Heavy Atom Count: 15
• Complexity: 191

Purity/Quality:

ETHYL 3-[(4-FLUOROPHENYL)THIO]PROPANOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CCSC1=CC=C(C=C1)F