Ethyl 3-[3,5-bis(trifluoromethyl)phenyl]propanoate

Base Information

• Chemical Name: Ethyl 3-[3,5-bis(trifluoromethyl)phenyl]propanoate
• CAS No.: 184969-50-4
• Molecular Formula: C13H12 F6 O2
• Molecular Weight: 314.2235992
• DSSTox Substance ID: DTXSID00700699
• Wikidata: Q82632146
• Mol file: 184969-50-4.mol

Synonyms:184969-50-4;ETHYL 3-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]PROPANOATE;DTXSID00700699;3-(3,5-BIS-TRIFLUOROMETHYL-PHENYL)-PROPIONIC ACID ETHYL ESTER

Chemical Property of Ethyl 3-[3,5-bis(trifluoromethyl)phenyl]propanoate

Chemical Property:

• PSA: 26.30000
• LogP: 4.21990
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 314.07414859
• Heavy Atom Count: 21
• Complexity: 328

Purity/Quality:

97% ^*data from raw suppliers

3-(3,5-BIS-TRIFLUOROMETHYL-PHENYL)-PROPIONIC ACID ETHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

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