5-(4-ethylphenyl)-1,2-oxazole-3-carboxylic Acid

Base Information

• Chemical Name: 5-(4-ethylphenyl)-1,2-oxazole-3-carboxylic Acid
• CAS No.: 887360-50-1
• Molecular Formula: C12H11NO3
• Molecular Weight: 217.22
• DSSTox Substance ID: DTXSID40427994
• Wikidata: Q82240755
• Mol file: 887360-50-1.mol

Synonyms:887360-50-1;5-(4-ethylphenyl)-1,2-oxazole-3-carboxylic Acid;5-(4-ethylphenyl)isoxazole-3-carboxylic acid;5-(4-ETHYL-PHENYL)-ISOXAZOLE-3-CARBOXYLIC ACID;SCHEMBL4083150;DTXSID40427994;FNTZJQFGZFDXPX-UHFFFAOYSA-N;BBL021272;MFCD07403668;STK893978;AKOS002657760;5-(4-ethylphenyl)isoxazole-3-carboxylicacid;EN300-238104;F1967-0235

Chemical Property of 5-(4-ethylphenyl)-1,2-oxazole-3-carboxylic Acid

Chemical Property:

• PSA: 63.33000
• LogP: 2.60220
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 217.07389321
• Heavy Atom Count: 16
• Complexity: 249

Purity/Quality:

NLT 98% ^*data from raw suppliers

5-(4-ethylphenyl)-1,2-oxazole-3-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC=C(C=C1)C2=CC(=NO2)C(=O)O

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