3-[3-Methyl-5-(trifluoromethoxy)phenyl]propionic acid

Base Information

• Chemical Name: 3-[3-Methyl-5-(trifluoromethoxy)phenyl]propionic acid
• CAS No.: 916420-57-0
• Molecular Formula: C11H11F3O3
• Molecular Weight: 248.20
• Mol file: 916420-57-0.mol

Synonyms:916420-57-0;3-[3-METHYL-5-(TRIFLUOROMETHOXY)PHENYL]PROPIONIC ACID;3-(3-Methyl-5-(trifluoromethoxy)phenyl)propanoic acid;3-[3-methyl-5-(trifluoromethoxy)phenyl]propanoic acid;MFCD09025376;AKOS015956864;JS-4611;CS-0321840;3-(3-Methyl-5-(trifluoromethoxy)phenyl)propanoicacid;3-[3-Methyl-5-(trifluoromethoxy)-phenyl]propionic acid

Chemical Property of 3-[3-Methyl-5-(trifluoromethoxy)phenyl]propionic acid

Chemical Property:

• PKA: 4.58±0.10(Predicted)
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 248.06602869
• Heavy Atom Count: 17
• Complexity: 265

Purity/Quality:

99% ^*data from raw suppliers

3-[3-Methyl-5-(trifluoromethoxy)phenyl]propionic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1)OC(F)(F)F)CCC(=O)O

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